USER MOD reduce.3.24.130724 H: found=0, std=0, add=1007, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 1006 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 46 THR OG1 : rot 74:sc= 1.22 USER MOD Set 1.2: A 145 SER OG : rot 180:sc= 0 USER MOD Single : A 37 LYS NZ :NH3+ -118:sc= -0.24 (180deg=-1.27) USER MOD Single : A 38 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0132) USER MOD Single : A 40 ASN : amide:sc= -2.29! C(o=-2.3!,f=-6.8!) USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0369) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 SER OG : rot 136:sc= 0.564 USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 ASN : amide:sc= -2.33! C(o=-2.3!,f=-3.9!) USER MOD Single : A 57 LYS NZ :NH3+ -154:sc= 0 (180deg=-0.242) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 LYS NZ :NH3+ -176:sc= 0.0626 (180deg=0.0583) USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 LYS NZ :NH3+ -168:sc= -4.33! (180deg=-4.86!) USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 89 HIS : no HD1:sc= -0.244 K(o=-0.24,f=-1.2) USER MOD Single : A 94 CYS SG : rot -50:sc= -0.274 USER MOD Single : A 97 HIS : no HD1:sc= -0.0662 X(o=-0.066,f=-0.084) USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 101 TYR OH : rot -79:sc= -2.09 USER MOD Single : A 106 SER OG : rot 180:sc= -1.29 USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 116 THR OG1 : rot 45:sc= 0.563 USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 THR OG1 : rot 130:sc= 0 USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 129 SER OG : rot 106:sc= 0.833 USER MOD Single : A 130 ASN : amide:sc= 0 X(o=0,f=0.46) USER MOD Single : A 131 LYS NZ :NH3+ -122:sc= 0 (180deg=-0.0705) USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 LYS NZ :NH3+ -170:sc= 1.68 (180deg=1.33) USER MOD Single : A 137 ASN : amide:sc= -0.349 X(o=-0.35,f=0) USER MOD Single : A 138 LYS NZ :NH3+ 179:sc= -0.394 (180deg=-0.421) USER MOD Single : A 142 TYR OH : rot -140:sc= -1.99! USER MOD Single : A 143 LYS NZ :NH3+ -165:sc= 0.395 (180deg=0.318) USER MOD Single : A 147 ASN : amide:sc= -0.0703 X(o=-0.07,f=-0.17) USER MOD Single : A 151 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 154 GLN : amide:sc= -1.81 X(o=-1.8,f=-1.9) USER MOD ----------------------------------------------------------------- ATOM 12 N LYS A 37 1.294 -3.470 -0.131 1.00 35.15 N ATOM 13 CA LYS A 37 1.341 -4.722 -0.877 1.00 4.21 C ATOM 14 C LYS A 37 -0.009 -5.025 -1.518 1.00 41.33 C ATOM 15 O LYS A 37 -0.134 -5.051 -2.743 1.00 15.01 O ATOM 16 CB LYS A 37 1.750 -5.873 0.044 1.00 22.44 C ATOM 17 CG LYS A 37 2.500 -6.986 -0.668 1.00 41.53 C ATOM 18 CD LYS A 37 3.105 -7.971 0.318 1.00 73.14 C ATOM 19 CE LYS A 37 2.033 -8.644 1.161 1.00 72.41 C ATOM 20 NZ LYS A 37 1.746 -7.881 2.407 1.00 44.22 N ATOM 0 HA LYS A 37 2.083 -4.616 -1.668 1.00 4.21 H new ATOM 0 HB2 LYS A 37 2.375 -5.481 0.846 1.00 22.44 H new ATOM 0 HB3 LYS A 37 0.857 -6.289 0.510 1.00 22.44 H new ATOM 0 HG2 LYS A 37 1.821 -7.512 -1.339 1.00 41.53 H new ATOM 0 HG3 LYS A 37 3.289 -6.557 -1.285 1.00 41.53 H new ATOM 0 HD2 LYS A 37 3.672 -8.728 -0.224 1.00 73.14 H new ATOM 0 HD3 LYS A 37 3.808 -7.451 0.969 1.00 73.14 H new ATOM 0 HE2 LYS A 37 1.119 -8.741 0.576 1.00 72.41 H new ATOM 0 HE3 LYS A 37 2.354 -9.653 1.419 1.00 72.41 H new ATOM 0 HZ1 LYS A 37 1.976 -8.468 3.234 1.00 44.22 H new ATOM 0 HZ2 LYS A 37 2.323 -7.016 2.425 1.00 44.22 H new ATOM 0 HZ3 LYS A 37 0.738 -7.625 2.433 1.00 44.22 H new ATOM 34 N LYS A 38 -1.018 -5.252 -0.684 1.00 3.32 N ATOM 35 CA LYS A 38 -2.360 -5.550 -1.169 1.00 10.04 C ATOM 36 C LYS A 38 -2.968 -4.338 -1.867 1.00 13.24 C ATOM 37 O LYS A 38 -3.911 -4.467 -2.648 1.00 74.24 O ATOM 38 CB LYS A 38 -3.258 -5.988 -0.009 1.00 43.30 C ATOM 39 CG LYS A 38 -3.427 -4.926 1.064 1.00 41.23 C ATOM 40 CD LYS A 38 -4.815 -4.972 1.681 1.00 63.54 C ATOM 41 CE LYS A 38 -4.856 -5.894 2.890 1.00 13.42 C ATOM 42 NZ LYS A 38 -5.029 -7.319 2.496 1.00 25.31 N ATOM 0 H LYS A 38 -0.931 -5.235 0.332 1.00 3.32 H new ATOM 0 HA LYS A 38 -2.286 -6.363 -1.891 1.00 10.04 H new ATOM 0 HB2 LYS A 38 -4.239 -6.256 -0.401 1.00 43.30 H new ATOM 0 HB3 LYS A 38 -2.840 -6.887 0.444 1.00 43.30 H new ATOM 0 HG2 LYS A 38 -2.677 -5.071 1.842 1.00 41.23 H new ATOM 0 HG3 LYS A 38 -3.252 -3.940 0.632 1.00 41.23 H new ATOM 0 HD2 LYS A 38 -5.116 -3.967 1.978 1.00 63.54 H new ATOM 0 HD3 LYS A 38 -5.534 -5.314 0.937 1.00 63.54 H new ATOM 0 HE2 LYS A 38 -3.934 -5.785 3.461 1.00 13.42 H new ATOM 0 HE3 LYS A 38 -5.674 -5.597 3.546 1.00 13.42 H new ATOM 0 HZ1 LYS A 38 -5.137 -7.904 3.349 1.00 25.31 H new ATOM 0 HZ2 LYS A 38 -5.877 -7.414 1.901 1.00 25.31 H new ATOM 0 HZ3 LYS A 38 -4.194 -7.635 1.962 1.00 25.31 H new ATOM 56 N LEU A 39 -2.423 -3.161 -1.581 1.00 5.20 N ATOM 57 CA LEU A 39 -2.911 -1.925 -2.183 1.00 4.11 C ATOM 58 C LEU A 39 -2.988 -2.052 -3.701 1.00 33.11 C ATOM 59 O LEU A 39 -4.053 -1.883 -4.294 1.00 43.20 O ATOM 60 CB LEU A 39 -2.000 -0.756 -1.804 1.00 12.53 C ATOM 61 CG LEU A 39 -2.439 0.072 -0.595 1.00 41.11 C ATOM 62 CD1 LEU A 39 -2.642 -0.822 0.619 1.00 43.54 C ATOM 63 CD2 LEU A 39 -1.418 1.160 -0.294 1.00 62.54 C ATOM 0 H LEU A 39 -1.643 -3.036 -0.936 1.00 5.20 H new ATOM 0 HA LEU A 39 -3.914 -1.735 -1.801 1.00 4.11 H new ATOM 0 HB2 LEU A 39 -1.002 -1.148 -1.608 1.00 12.53 H new ATOM 0 HB3 LEU A 39 -1.918 -0.091 -2.664 1.00 12.53 H new ATOM 0 HG LEU A 39 -3.390 0.550 -0.832 1.00 41.11 H new ATOM 0 HD11 LEU A 39 -2.954 -0.216 1.469 1.00 43.54 H new ATOM 0 HD12 LEU A 39 -3.411 -1.563 0.400 1.00 43.54 H new ATOM 0 HD13 LEU A 39 -1.707 -1.329 0.858 1.00 43.54 H new ATOM 0 HD21 LEU A 39 -1.747 1.739 0.569 1.00 62.54 H new ATOM 0 HD22 LEU A 39 -0.452 0.703 -0.078 1.00 62.54 H new ATOM 0 HD23 LEU A 39 -1.323 1.818 -1.157 1.00 62.54 H new ATOM 75 N ASN A 40 -1.853 -2.354 -4.323 1.00 53.42 N ATOM 76 CA ASN A 40 -1.793 -2.506 -5.772 1.00 52.44 C ATOM 77 C ASN A 40 -2.901 -3.429 -6.269 1.00 32.41 C ATOM 78 O ASN A 40 -3.661 -3.077 -7.172 1.00 24.41 O ATOM 79 CB ASN A 40 -0.429 -3.056 -6.192 1.00 43.33 C ATOM 80 CG ASN A 40 -0.430 -3.581 -7.615 1.00 21.01 C ATOM 81 OD1 ASN A 40 -0.169 -2.840 -8.562 1.00 50.44 O ATOM 82 ND2 ASN A 40 -0.725 -4.866 -7.771 1.00 22.45 N ATOM 0 H ASN A 40 -0.963 -2.498 -3.846 1.00 53.42 H new ATOM 0 HA ASN A 40 -1.935 -1.523 -6.221 1.00 52.44 H new ATOM 0 HB2 ASN A 40 0.321 -2.271 -6.098 1.00 43.33 H new ATOM 0 HB3 ASN A 40 -0.138 -3.857 -5.512 1.00 43.33 H new ATOM 0 HD21 ASN A 40 -0.742 -5.276 -8.705 1.00 22.45 H new ATOM 0 HD22 ASN A 40 -0.935 -5.444 -6.957 1.00 22.45 H new ATOM 89 N LYS A 41 -2.988 -4.613 -5.672 1.00 73.54 N ATOM 90 CA LYS A 41 -4.004 -5.589 -6.051 1.00 42.32 C ATOM 91 C LYS A 41 -5.396 -4.965 -6.019 1.00 24.43 C ATOM 92 O LYS A 41 -6.077 -4.889 -7.041 1.00 52.02 O ATOM 93 CB LYS A 41 -3.953 -6.798 -5.115 1.00 32.31 C ATOM 94 CG LYS A 41 -2.617 -7.521 -5.126 1.00 52.25 C ATOM 95 CD LYS A 41 -2.503 -8.500 -3.970 1.00 43.11 C ATOM 96 CE LYS A 41 -1.076 -8.583 -3.449 1.00 12.30 C ATOM 97 NZ LYS A 41 -0.935 -9.610 -2.380 1.00 41.20 N ATOM 0 H LYS A 41 -2.367 -4.920 -4.923 1.00 73.54 H new ATOM 0 HA LYS A 41 -3.796 -5.917 -7.069 1.00 42.32 H new ATOM 0 HB2 LYS A 41 -4.170 -6.469 -4.099 1.00 32.31 H new ATOM 0 HB3 LYS A 41 -4.738 -7.499 -5.398 1.00 32.31 H new ATOM 0 HG2 LYS A 41 -2.499 -8.055 -6.069 1.00 52.25 H new ATOM 0 HG3 LYS A 41 -1.808 -6.793 -5.068 1.00 52.25 H new ATOM 0 HD2 LYS A 41 -3.169 -8.192 -3.164 1.00 43.11 H new ATOM 0 HD3 LYS A 41 -2.831 -9.488 -4.294 1.00 43.11 H new ATOM 0 HE2 LYS A 41 -0.402 -8.821 -4.272 1.00 12.30 H new ATOM 0 HE3 LYS A 41 -0.774 -7.610 -3.060 1.00 12.30 H new ATOM 0 HZ1 LYS A 41 0.051 -9.636 -2.051 1.00 41.20 H new ATOM 0 HZ2 LYS A 41 -1.559 -9.370 -1.583 1.00 41.20 H new ATOM 0 HZ3 LYS A 41 -1.199 -10.543 -2.758 1.00 41.20 H new ATOM 111 N LYS A 42 -5.812 -4.520 -4.838 1.00 42.53 N ATOM 112 CA LYS A 42 -7.121 -3.900 -4.672 1.00 52.12 C ATOM 113 C LYS A 42 -7.368 -2.852 -5.753 1.00 34.30 C ATOM 114 O LYS A 42 -8.484 -2.715 -6.255 1.00 11.11 O ATOM 115 CB LYS A 42 -7.232 -3.256 -3.288 1.00 62.22 C ATOM 116 CG LYS A 42 -7.390 -4.262 -2.161 1.00 12.53 C ATOM 117 CD LYS A 42 -8.854 -4.551 -1.873 1.00 61.24 C ATOM 118 CE LYS A 42 -9.088 -4.829 -0.396 1.00 65.34 C ATOM 119 NZ LYS A 42 -8.438 -6.097 0.039 1.00 54.03 N ATOM 0 H LYS A 42 -5.261 -4.577 -3.981 1.00 42.53 H new ATOM 0 HA LYS A 42 -7.878 -4.679 -4.765 1.00 52.12 H new ATOM 0 HB2 LYS A 42 -6.342 -2.654 -3.104 1.00 62.22 H new ATOM 0 HB3 LYS A 42 -8.084 -2.577 -3.280 1.00 62.22 H new ATOM 0 HG2 LYS A 42 -6.880 -5.189 -2.425 1.00 12.53 H new ATOM 0 HG3 LYS A 42 -6.910 -3.879 -1.260 1.00 12.53 H new ATOM 0 HD2 LYS A 42 -9.462 -3.702 -2.185 1.00 61.24 H new ATOM 0 HD3 LYS A 42 -9.179 -5.409 -2.462 1.00 61.24 H new ATOM 0 HE2 LYS A 42 -8.700 -4.000 0.196 1.00 65.34 H new ATOM 0 HE3 LYS A 42 -10.159 -4.885 -0.202 1.00 65.34 H new ATOM 0 HZ1 LYS A 42 -8.620 -6.251 1.051 1.00 54.03 H new ATOM 0 HZ2 LYS A 42 -8.827 -6.892 -0.508 1.00 54.03 H new ATOM 0 HZ3 LYS A 42 -7.412 -6.035 -0.122 1.00 54.03 H new ATOM 133 N VAL A 43 -6.320 -2.116 -6.108 1.00 71.11 N ATOM 134 CA VAL A 43 -6.423 -1.083 -7.131 1.00 50.34 C ATOM 135 C VAL A 43 -6.703 -1.691 -8.501 1.00 21.31 C ATOM 136 O VAL A 43 -7.522 -1.178 -9.265 1.00 65.20 O ATOM 137 CB VAL A 43 -5.136 -0.240 -7.210 1.00 31.14 C ATOM 138 CG1 VAL A 43 -5.251 0.811 -8.303 1.00 72.34 C ATOM 139 CG2 VAL A 43 -4.842 0.408 -5.865 1.00 44.02 C ATOM 0 H VAL A 43 -5.390 -2.216 -5.702 1.00 71.11 H new ATOM 0 HA VAL A 43 -7.254 -0.438 -6.846 1.00 50.34 H new ATOM 0 HB VAL A 43 -4.305 -0.900 -7.461 1.00 31.14 H new ATOM 0 HG11 VAL A 43 -4.332 1.396 -8.343 1.00 72.34 H new ATOM 0 HG12 VAL A 43 -5.411 0.321 -9.263 1.00 72.34 H new ATOM 0 HG13 VAL A 43 -6.092 1.470 -8.087 1.00 72.34 H new ATOM 0 HG21 VAL A 43 -3.930 1.000 -5.938 1.00 44.02 H new ATOM 0 HG22 VAL A 43 -5.673 1.055 -5.584 1.00 44.02 H new ATOM 0 HG23 VAL A 43 -4.713 -0.366 -5.109 1.00 44.02 H new ATOM 149 N LEU A 44 -6.019 -2.788 -8.805 1.00 63.44 N ATOM 150 CA LEU A 44 -6.194 -3.469 -10.084 1.00 23.01 C ATOM 151 C LEU A 44 -7.627 -3.964 -10.246 1.00 15.34 C ATOM 152 O LEU A 44 -8.226 -3.827 -11.313 1.00 35.14 O ATOM 153 CB LEU A 44 -5.221 -4.644 -10.196 1.00 21.23 C ATOM 154 CG LEU A 44 -5.128 -5.310 -11.569 1.00 62.01 C ATOM 155 CD1 LEU A 44 -4.922 -4.266 -12.656 1.00 22.04 C ATOM 156 CD2 LEU A 44 -4.002 -6.334 -11.590 1.00 40.32 C ATOM 0 H LEU A 44 -5.338 -3.225 -8.184 1.00 63.44 H new ATOM 0 HA LEU A 44 -5.984 -2.754 -10.880 1.00 23.01 H new ATOM 0 HB2 LEU A 44 -4.227 -4.295 -9.916 1.00 21.23 H new ATOM 0 HB3 LEU A 44 -5.511 -5.400 -9.466 1.00 21.23 H new ATOM 0 HG LEU A 44 -6.067 -5.828 -11.765 1.00 62.01 H new ATOM 0 HD11 LEU A 44 -4.858 -4.759 -13.626 1.00 22.04 H new ATOM 0 HD12 LEU A 44 -5.762 -3.571 -12.657 1.00 22.04 H new ATOM 0 HD13 LEU A 44 -3.998 -3.719 -12.465 1.00 22.04 H new ATOM 0 HD21 LEU A 44 -3.951 -6.798 -12.575 1.00 40.32 H new ATOM 0 HD22 LEU A 44 -3.056 -5.839 -11.372 1.00 40.32 H new ATOM 0 HD23 LEU A 44 -4.192 -7.100 -10.838 1.00 40.32 H new ATOM 168 N LYS A 45 -8.174 -4.538 -9.179 1.00 3.51 N ATOM 169 CA LYS A 45 -9.539 -5.050 -9.200 1.00 3.11 C ATOM 170 C LYS A 45 -10.544 -3.913 -9.356 1.00 31.41 C ATOM 171 O LYS A 45 -11.456 -3.985 -10.181 1.00 21.44 O ATOM 172 CB LYS A 45 -9.832 -5.832 -7.917 1.00 44.33 C ATOM 173 CG LYS A 45 -8.730 -6.805 -7.533 1.00 55.14 C ATOM 174 CD LYS A 45 -8.344 -7.698 -8.700 1.00 63.03 C ATOM 175 CE LYS A 45 -9.523 -8.530 -9.180 1.00 71.11 C ATOM 176 NZ LYS A 45 -9.081 -9.775 -9.868 1.00 4.42 N ATOM 0 H LYS A 45 -7.692 -4.660 -8.288 1.00 3.51 H new ATOM 0 HA LYS A 45 -9.637 -5.718 -10.056 1.00 3.11 H new ATOM 0 HB2 LYS A 45 -9.985 -5.128 -7.099 1.00 44.33 H new ATOM 0 HB3 LYS A 45 -10.764 -6.383 -8.042 1.00 44.33 H new ATOM 0 HG2 LYS A 45 -7.855 -6.250 -7.193 1.00 55.14 H new ATOM 0 HG3 LYS A 45 -9.062 -7.420 -6.697 1.00 55.14 H new ATOM 0 HD2 LYS A 45 -7.972 -7.085 -9.521 1.00 63.03 H new ATOM 0 HD3 LYS A 45 -7.530 -8.358 -8.401 1.00 63.03 H new ATOM 0 HE2 LYS A 45 -10.154 -8.789 -8.330 1.00 71.11 H new ATOM 0 HE3 LYS A 45 -10.133 -7.936 -9.861 1.00 71.11 H new ATOM 0 HZ1 LYS A 45 -9.914 -10.314 -10.180 1.00 4.42 H new ATOM 0 HZ2 LYS A 45 -8.500 -9.527 -10.694 1.00 4.42 H new ATOM 0 HZ3 LYS A 45 -8.520 -10.354 -9.211 1.00 4.42 H new ATOM 190 N THR A 46 -10.372 -2.863 -8.559 1.00 64.03 N ATOM 191 CA THR A 46 -11.263 -1.711 -8.609 1.00 73.33 C ATOM 192 C THR A 46 -11.337 -1.134 -10.018 1.00 53.02 C ATOM 193 O THR A 46 -12.419 -1.010 -10.593 1.00 63.02 O ATOM 194 CB THR A 46 -10.809 -0.606 -7.637 1.00 63.32 C ATOM 195 OG1 THR A 46 -10.744 -1.124 -6.303 1.00 42.54 O ATOM 196 CG2 THR A 46 -11.762 0.579 -7.681 1.00 64.31 C ATOM 0 H THR A 46 -9.623 -2.787 -7.871 1.00 64.03 H new ATOM 0 HA THR A 46 -12.251 -2.063 -8.311 1.00 73.33 H new ATOM 0 HB THR A 46 -9.819 -0.267 -7.943 1.00 63.32 H new ATOM 0 HG1 THR A 46 -9.959 -1.704 -6.215 1.00 42.54 H new ATOM 0 HG21 THR A 46 -11.421 1.346 -6.986 1.00 64.31 H new ATOM 0 HG22 THR A 46 -11.787 0.989 -8.691 1.00 64.31 H new ATOM 0 HG23 THR A 46 -12.762 0.252 -7.398 1.00 64.31 H new ATOM 204 N VAL A 47 -10.180 -0.782 -10.570 1.00 73.53 N ATOM 205 CA VAL A 47 -10.114 -0.220 -11.914 1.00 1.44 C ATOM 206 C VAL A 47 -10.647 -1.204 -12.949 1.00 14.53 C ATOM 207 O VAL A 47 -11.300 -0.811 -13.916 1.00 74.40 O ATOM 208 CB VAL A 47 -8.672 0.171 -12.288 1.00 22.10 C ATOM 209 CG1 VAL A 47 -7.788 -1.065 -12.371 1.00 13.42 C ATOM 210 CG2 VAL A 47 -8.652 0.939 -13.601 1.00 11.54 C ATOM 0 H VAL A 47 -9.276 -0.876 -10.107 1.00 73.53 H new ATOM 0 HA VAL A 47 -10.737 0.674 -11.914 1.00 1.44 H new ATOM 0 HB VAL A 47 -8.276 0.820 -11.507 1.00 22.10 H new ATOM 0 HG11 VAL A 47 -6.773 -0.769 -12.636 1.00 13.42 H new ATOM 0 HG12 VAL A 47 -7.778 -1.571 -11.405 1.00 13.42 H new ATOM 0 HG13 VAL A 47 -8.179 -1.742 -13.131 1.00 13.42 H new ATOM 0 HG21 VAL A 47 -7.625 1.207 -13.850 1.00 11.54 H new ATOM 0 HG22 VAL A 47 -9.067 0.316 -14.393 1.00 11.54 H new ATOM 0 HG23 VAL A 47 -9.250 1.845 -13.502 1.00 11.54 H new ATOM 220 N LYS A 48 -10.366 -2.485 -12.739 1.00 45.11 N ATOM 221 CA LYS A 48 -10.818 -3.528 -13.652 1.00 41.33 C ATOM 222 C LYS A 48 -12.341 -3.603 -13.681 1.00 11.32 C ATOM 223 O LYS A 48 -12.939 -3.916 -14.711 1.00 4.42 O ATOM 224 CB LYS A 48 -10.238 -4.882 -13.240 1.00 24.41 C ATOM 225 CG LYS A 48 -10.740 -6.041 -14.083 1.00 71.42 C ATOM 226 CD LYS A 48 -10.297 -7.379 -13.514 1.00 10.33 C ATOM 227 CE LYS A 48 -10.740 -8.535 -14.397 1.00 34.03 C ATOM 228 NZ LYS A 48 -12.220 -8.701 -14.392 1.00 53.43 N ATOM 0 H LYS A 48 -9.827 -2.826 -11.943 1.00 45.11 H new ATOM 0 HA LYS A 48 -10.465 -3.278 -14.652 1.00 41.33 H new ATOM 0 HB2 LYS A 48 -9.151 -4.838 -13.308 1.00 24.41 H new ATOM 0 HB3 LYS A 48 -10.484 -5.070 -12.195 1.00 24.41 H new ATOM 0 HG2 LYS A 48 -11.828 -6.009 -14.135 1.00 71.42 H new ATOM 0 HG3 LYS A 48 -10.369 -5.938 -15.103 1.00 71.42 H new ATOM 0 HD2 LYS A 48 -9.212 -7.391 -13.414 1.00 10.33 H new ATOM 0 HD3 LYS A 48 -10.711 -7.505 -12.513 1.00 10.33 H new ATOM 0 HE2 LYS A 48 -10.397 -8.365 -15.418 1.00 34.03 H new ATOM 0 HE3 LYS A 48 -10.270 -9.456 -14.052 1.00 34.03 H new ATOM 0 HZ1 LYS A 48 -12.475 -9.559 -14.922 1.00 53.43 H new ATOM 0 HZ2 LYS A 48 -12.556 -8.787 -13.412 1.00 53.43 H new ATOM 0 HZ3 LYS A 48 -12.664 -7.873 -14.839 1.00 53.43 H new ATOM 242 N LYS A 49 -12.965 -3.312 -12.544 1.00 24.41 N ATOM 243 CA LYS A 49 -14.419 -3.344 -12.438 1.00 45.04 C ATOM 244 C LYS A 49 -15.039 -2.117 -13.099 1.00 63.13 C ATOM 245 O LYS A 49 -16.011 -2.227 -13.845 1.00 71.34 O ATOM 246 CB LYS A 49 -14.842 -3.414 -10.970 1.00 34.43 C ATOM 247 CG LYS A 49 -14.278 -4.615 -10.230 1.00 62.15 C ATOM 248 CD LYS A 49 -15.322 -5.706 -10.059 1.00 2.33 C ATOM 249 CE LYS A 49 -15.264 -6.717 -11.194 1.00 2.44 C ATOM 250 NZ LYS A 49 -15.775 -8.051 -10.774 1.00 62.15 N ATOM 0 H LYS A 49 -12.486 -3.051 -11.682 1.00 24.41 H new ATOM 0 HA LYS A 49 -14.777 -4.234 -12.956 1.00 45.04 H new ATOM 0 HB2 LYS A 49 -14.521 -2.503 -10.465 1.00 34.43 H new ATOM 0 HB3 LYS A 49 -15.930 -3.443 -10.915 1.00 34.43 H new ATOM 0 HG2 LYS A 49 -13.422 -5.011 -10.777 1.00 62.15 H new ATOM 0 HG3 LYS A 49 -13.914 -4.302 -9.251 1.00 62.15 H new ATOM 0 HD2 LYS A 49 -15.165 -6.216 -9.108 1.00 2.33 H new ATOM 0 HD3 LYS A 49 -16.315 -5.258 -10.020 1.00 2.33 H new ATOM 0 HE2 LYS A 49 -15.851 -6.352 -12.036 1.00 2.44 H new ATOM 0 HE3 LYS A 49 -14.235 -6.815 -11.541 1.00 2.44 H new ATOM 0 HZ1 LYS A 49 -15.719 -8.712 -11.575 1.00 62.15 H new ATOM 0 HZ2 LYS A 49 -15.199 -8.411 -9.987 1.00 62.15 H new ATOM 0 HZ3 LYS A 49 -16.765 -7.963 -10.467 1.00 62.15 H new ATOM 264 N ALA A 50 -14.469 -0.949 -12.821 1.00 61.11 N ATOM 265 CA ALA A 50 -14.964 0.298 -13.392 1.00 20.55 C ATOM 266 C ALA A 50 -14.657 0.379 -14.883 1.00 4.01 C ATOM 267 O ALA A 50 -15.308 1.118 -15.621 1.00 42.11 O ATOM 268 CB ALA A 50 -14.362 1.488 -12.661 1.00 5.34 C ATOM 0 H ALA A 50 -13.664 -0.840 -12.204 1.00 61.11 H new ATOM 0 HA ALA A 50 -16.047 0.321 -13.270 1.00 20.55 H new ATOM 0 HB1 ALA A 50 -14.740 2.412 -13.098 1.00 5.34 H new ATOM 0 HB2 ALA A 50 -14.638 1.445 -11.607 1.00 5.34 H new ATOM 0 HB3 ALA A 50 -13.276 1.461 -12.754 1.00 5.34 H new ATOM 274 N SER A 51 -13.660 -0.385 -15.320 1.00 11.53 N ATOM 275 CA SER A 51 -13.263 -0.395 -16.723 1.00 15.11 C ATOM 276 C SER A 51 -14.458 -0.698 -17.623 1.00 3.03 C ATOM 277 O SER A 51 -14.573 -0.160 -18.724 1.00 62.12 O ATOM 278 CB SER A 51 -12.160 -1.429 -16.955 1.00 51.12 C ATOM 279 OG SER A 51 -11.085 -0.871 -17.691 1.00 74.25 O ATOM 0 H SER A 51 -13.113 -1.005 -14.722 1.00 11.53 H new ATOM 0 HA SER A 51 -12.882 0.595 -16.975 1.00 15.11 H new ATOM 0 HB2 SER A 51 -11.796 -1.798 -15.996 1.00 51.12 H new ATOM 0 HB3 SER A 51 -12.567 -2.285 -17.492 1.00 51.12 H new ATOM 0 HG SER A 51 -10.235 -1.149 -17.291 1.00 74.25 H new ATOM 285 N LYS A 52 -15.345 -1.564 -17.145 1.00 53.24 N ATOM 286 CA LYS A 52 -16.533 -1.940 -17.904 1.00 4.42 C ATOM 287 C LYS A 52 -17.513 -0.774 -17.992 1.00 70.43 C ATOM 288 O LYS A 52 -18.351 -0.723 -18.892 1.00 61.11 O ATOM 289 CB LYS A 52 -17.216 -3.147 -17.257 1.00 4.55 C ATOM 290 CG LYS A 52 -18.587 -3.451 -17.834 1.00 31.14 C ATOM 291 CD LYS A 52 -18.508 -3.786 -19.314 1.00 4.33 C ATOM 292 CE LYS A 52 -19.839 -4.296 -19.842 1.00 73.31 C ATOM 293 NZ LYS A 52 -19.735 -4.761 -21.253 1.00 41.10 N ATOM 0 H LYS A 52 -15.264 -2.019 -16.236 1.00 53.24 H new ATOM 0 HA LYS A 52 -16.220 -2.206 -18.914 1.00 4.42 H new ATOM 0 HB2 LYS A 52 -16.578 -4.023 -17.377 1.00 4.55 H new ATOM 0 HB3 LYS A 52 -17.313 -2.968 -16.186 1.00 4.55 H new ATOM 0 HG2 LYS A 52 -19.033 -4.287 -17.294 1.00 31.14 H new ATOM 0 HG3 LYS A 52 -19.242 -2.592 -17.689 1.00 31.14 H new ATOM 0 HD2 LYS A 52 -18.209 -2.899 -19.873 1.00 4.33 H new ATOM 0 HD3 LYS A 52 -17.738 -4.540 -19.477 1.00 4.33 H new ATOM 0 HE2 LYS A 52 -20.188 -5.116 -19.214 1.00 73.31 H new ATOM 0 HE3 LYS A 52 -20.584 -3.503 -19.775 1.00 73.31 H new ATOM 0 HZ1 LYS A 52 -20.663 -5.101 -21.576 1.00 41.10 H new ATOM 0 HZ2 LYS A 52 -19.426 -3.972 -21.857 1.00 41.10 H new ATOM 0 HZ3 LYS A 52 -19.043 -5.535 -21.313 1.00 41.10 H new ATOM 307 N ALA A 53 -17.401 0.160 -17.054 1.00 33.35 N ATOM 308 CA ALA A 53 -18.276 1.326 -17.028 1.00 64.32 C ATOM 309 C ALA A 53 -17.665 2.487 -17.805 1.00 65.00 C ATOM 310 O ALA A 53 -18.114 3.628 -17.692 1.00 63.25 O ATOM 311 CB ALA A 53 -18.561 1.741 -15.592 1.00 65.43 C ATOM 0 H ALA A 53 -16.713 0.132 -16.302 1.00 33.35 H new ATOM 0 HA ALA A 53 -19.216 1.055 -17.509 1.00 64.32 H new ATOM 0 HB1 ALA A 53 -19.215 2.613 -15.588 1.00 65.43 H new ATOM 0 HB2 ALA A 53 -19.047 0.920 -15.066 1.00 65.43 H new ATOM 0 HB3 ALA A 53 -17.625 1.988 -15.092 1.00 65.43 H new ATOM 317 N LYS A 54 -16.637 2.190 -18.593 1.00 61.22 N ATOM 318 CA LYS A 54 -15.964 3.208 -19.390 1.00 5.51 C ATOM 319 C LYS A 54 -15.475 4.354 -18.509 1.00 35.13 C ATOM 320 O LYS A 54 -15.344 5.488 -18.966 1.00 15.42 O ATOM 321 CB LYS A 54 -16.906 3.747 -20.469 1.00 21.11 C ATOM 322 CG LYS A 54 -16.192 4.184 -21.737 1.00 35.24 C ATOM 323 CD LYS A 54 -17.082 5.059 -22.604 1.00 21.04 C ATOM 324 CE LYS A 54 -16.914 6.532 -22.265 1.00 52.43 C ATOM 325 NZ LYS A 54 -17.943 7.376 -22.934 1.00 34.32 N ATOM 0 H LYS A 54 -16.252 1.251 -18.696 1.00 61.22 H new ATOM 0 HA LYS A 54 -15.100 2.746 -19.868 1.00 5.51 H new ATOM 0 HB2 LYS A 54 -17.636 2.977 -20.720 1.00 21.11 H new ATOM 0 HB3 LYS A 54 -17.462 4.593 -20.065 1.00 21.11 H new ATOM 0 HG2 LYS A 54 -15.286 4.731 -21.476 1.00 35.24 H new ATOM 0 HG3 LYS A 54 -15.882 3.305 -22.303 1.00 35.24 H new ATOM 0 HD2 LYS A 54 -16.842 4.896 -23.655 1.00 21.04 H new ATOM 0 HD3 LYS A 54 -18.124 4.769 -22.467 1.00 21.04 H new ATOM 0 HE2 LYS A 54 -16.980 6.666 -21.185 1.00 52.43 H new ATOM 0 HE3 LYS A 54 -15.920 6.863 -22.567 1.00 52.43 H new ATOM 0 HZ1 LYS A 54 -17.794 8.373 -22.678 1.00 34.32 H new ATOM 0 HZ2 LYS A 54 -17.864 7.268 -23.965 1.00 34.32 H new ATOM 0 HZ3 LYS A 54 -18.891 7.077 -22.627 1.00 34.32 H new ATOM 339 N ASN A 55 -15.207 4.048 -17.244 1.00 3.05 N ATOM 340 CA ASN A 55 -14.732 5.052 -16.299 1.00 1.43 C ATOM 341 C ASN A 55 -13.208 5.046 -16.217 1.00 74.43 C ATOM 342 O ASN A 55 -12.632 5.245 -15.148 1.00 31.02 O ATOM 343 CB ASN A 55 -15.329 4.801 -14.913 1.00 10.35 C ATOM 344 CG ASN A 55 -16.794 5.184 -14.836 1.00 54.31 C ATOM 345 OD1 ASN A 55 -17.236 6.128 -15.492 1.00 4.55 O ATOM 346 ND2 ASN A 55 -17.556 4.451 -14.033 1.00 13.11 N ATOM 0 H ASN A 55 -15.311 3.113 -16.850 1.00 3.05 H new ATOM 0 HA ASN A 55 -15.055 6.030 -16.655 1.00 1.43 H new ATOM 0 HB2 ASN A 55 -15.218 3.747 -14.658 1.00 10.35 H new ATOM 0 HB3 ASN A 55 -14.768 5.369 -14.171 1.00 10.35 H new ATOM 0 HD21 ASN A 55 -18.550 4.661 -13.941 1.00 13.11 H new ATOM 0 HD22 ASN A 55 -17.148 3.678 -13.508 1.00 13.11 H new ATOM 353 N VAL A 56 -12.561 4.815 -17.355 1.00 55.34 N ATOM 354 CA VAL A 56 -11.105 4.784 -17.414 1.00 40.21 C ATOM 355 C VAL A 56 -10.608 4.977 -18.842 1.00 52.14 C ATOM 356 O VAL A 56 -10.981 4.230 -19.748 1.00 1.43 O ATOM 357 CB VAL A 56 -10.549 3.457 -16.864 1.00 13.22 C ATOM 358 CG1 VAL A 56 -11.079 2.281 -17.670 1.00 42.11 C ATOM 359 CG2 VAL A 56 -9.028 3.475 -16.867 1.00 72.11 C ATOM 0 H VAL A 56 -13.023 4.647 -18.249 1.00 55.34 H new ATOM 0 HA VAL A 56 -10.746 5.605 -16.793 1.00 40.21 H new ATOM 0 HB VAL A 56 -10.886 3.341 -15.834 1.00 13.22 H new ATOM 0 HG11 VAL A 56 -10.675 1.352 -17.267 1.00 42.11 H new ATOM 0 HG12 VAL A 56 -12.167 2.260 -17.610 1.00 42.11 H new ATOM 0 HG13 VAL A 56 -10.775 2.387 -18.711 1.00 42.11 H new ATOM 0 HG21 VAL A 56 -8.652 2.530 -16.475 1.00 72.11 H new ATOM 0 HG22 VAL A 56 -8.668 3.614 -17.886 1.00 72.11 H new ATOM 0 HG23 VAL A 56 -8.673 4.294 -16.242 1.00 72.11 H new ATOM 369 N LYS A 57 -9.764 5.984 -19.038 1.00 63.03 N ATOM 370 CA LYS A 57 -9.213 6.276 -20.356 1.00 62.24 C ATOM 371 C LYS A 57 -7.688 6.307 -20.314 1.00 54.51 C ATOM 372 O LYS A 57 -7.094 6.707 -19.313 1.00 31.24 O ATOM 373 CB LYS A 57 -9.747 7.615 -20.870 1.00 73.53 C ATOM 374 CG LYS A 57 -11.239 7.797 -20.653 1.00 54.42 C ATOM 375 CD LYS A 57 -12.048 6.805 -21.472 1.00 42.23 C ATOM 376 CE LYS A 57 -12.145 7.233 -22.929 1.00 23.23 C ATOM 377 NZ LYS A 57 -13.264 8.189 -23.153 1.00 32.12 N ATOM 0 H LYS A 57 -9.446 6.612 -18.300 1.00 63.03 H new ATOM 0 HA LYS A 57 -9.524 5.483 -21.036 1.00 62.24 H new ATOM 0 HB2 LYS A 57 -9.214 8.425 -20.372 1.00 73.53 H new ATOM 0 HB3 LYS A 57 -9.530 7.699 -21.935 1.00 73.53 H new ATOM 0 HG2 LYS A 57 -11.471 7.672 -19.595 1.00 54.42 H new ATOM 0 HG3 LYS A 57 -11.526 8.813 -20.924 1.00 54.42 H new ATOM 0 HD2 LYS A 57 -11.586 5.819 -21.411 1.00 42.23 H new ATOM 0 HD3 LYS A 57 -13.049 6.715 -21.051 1.00 42.23 H new ATOM 0 HE2 LYS A 57 -11.206 7.695 -23.235 1.00 23.23 H new ATOM 0 HE3 LYS A 57 -12.287 6.354 -23.557 1.00 23.23 H new ATOM 0 HZ1 LYS A 57 -13.585 8.123 -24.140 1.00 32.12 H new ATOM 0 HZ2 LYS A 57 -14.053 7.956 -22.516 1.00 32.12 H new ATOM 0 HZ3 LYS A 57 -12.937 9.157 -22.959 1.00 32.12 H new ATOM 391 N ARG A 58 -7.062 5.886 -21.408 1.00 23.35 N ATOM 392 CA ARG A 58 -5.606 5.866 -21.495 1.00 15.34 C ATOM 393 C ARG A 58 -5.121 6.708 -22.671 1.00 71.45 C ATOM 394 O ARG A 58 -5.523 6.487 -23.813 1.00 61.11 O ATOM 395 CB ARG A 58 -5.102 4.429 -21.639 1.00 0.33 C ATOM 396 CG ARG A 58 -5.825 3.437 -20.743 1.00 11.24 C ATOM 397 CD ARG A 58 -6.859 2.636 -21.519 1.00 3.12 C ATOM 398 NE ARG A 58 -6.238 1.711 -22.463 1.00 41.01 N ATOM 399 CZ ARG A 58 -5.755 0.523 -22.118 1.00 21.30 C ATOM 400 NH1 ARG A 58 -5.821 0.117 -20.857 1.00 52.14 N ATOM 401 NH2 ARG A 58 -5.205 -0.263 -23.035 1.00 5.11 N ATOM 0 H ARG A 58 -7.539 5.554 -22.246 1.00 23.35 H new ATOM 0 HA ARG A 58 -5.206 6.293 -20.575 1.00 15.34 H new ATOM 0 HB2 ARG A 58 -5.214 4.116 -22.677 1.00 0.33 H new ATOM 0 HB3 ARG A 58 -4.036 4.402 -21.411 1.00 0.33 H new ATOM 0 HG2 ARG A 58 -5.101 2.758 -20.292 1.00 11.24 H new ATOM 0 HG3 ARG A 58 -6.313 3.970 -19.928 1.00 11.24 H new ATOM 0 HD2 ARG A 58 -7.483 2.078 -20.821 1.00 3.12 H new ATOM 0 HD3 ARG A 58 -7.516 3.318 -22.059 1.00 3.12 H new ATOM 0 HE ARG A 58 -6.172 1.993 -23.441 1.00 41.01 H new ATOM 0 HH11 ARG A 58 -6.244 0.718 -20.149 1.00 52.14 H new ATOM 0 HH12 ARG A 58 -5.449 -0.796 -20.595 1.00 52.14 H new ATOM 0 HH21 ARG A 58 -5.153 0.045 -24.006 1.00 5.11 H new ATOM 0 HH22 ARG A 58 -4.834 -1.175 -22.769 1.00 5.11 H new ATOM 415 N GLY A 59 -4.254 7.674 -22.384 1.00 70.10 N ATOM 416 CA GLY A 59 -3.729 8.534 -23.428 1.00 42.02 C ATOM 417 C GLY A 59 -3.642 9.984 -22.996 1.00 1.22 C ATOM 418 O GLY A 59 -4.528 10.488 -22.306 1.00 54.32 O ATOM 0 H GLY A 59 -3.906 7.876 -21.447 1.00 70.10 H new ATOM 0 HA2 GLY A 59 -2.738 8.185 -23.718 1.00 42.02 H new ATOM 0 HA3 GLY A 59 -4.365 8.459 -24.310 1.00 42.02 H new ATOM 422 N VAL A 60 -2.569 10.658 -23.400 1.00 74.52 N ATOM 423 CA VAL A 60 -2.369 12.059 -23.050 1.00 33.42 C ATOM 424 C VAL A 60 -3.596 12.893 -23.400 1.00 12.24 C ATOM 425 O VAL A 60 -3.990 13.785 -22.647 1.00 63.23 O ATOM 426 CB VAL A 60 -1.140 12.647 -23.768 1.00 32.32 C ATOM 427 CG1 VAL A 60 -1.253 12.445 -25.271 1.00 43.23 C ATOM 428 CG2 VAL A 60 -0.981 14.121 -23.430 1.00 11.33 C ATOM 0 H VAL A 60 -1.825 10.256 -23.970 1.00 74.52 H new ATOM 0 HA VAL A 60 -2.203 12.096 -21.973 1.00 33.42 H new ATOM 0 HB VAL A 60 -0.251 12.120 -23.421 1.00 32.32 H new ATOM 0 HG11 VAL A 60 -0.376 12.867 -25.762 1.00 43.23 H new ATOM 0 HG12 VAL A 60 -1.315 11.379 -25.491 1.00 43.23 H new ATOM 0 HG13 VAL A 60 -2.150 12.944 -25.639 1.00 43.23 H new ATOM 0 HG21 VAL A 60 -0.108 14.520 -23.946 1.00 11.33 H new ATOM 0 HG22 VAL A 60 -1.870 14.665 -23.748 1.00 11.33 H new ATOM 0 HG23 VAL A 60 -0.851 14.236 -22.354 1.00 11.33 H new ATOM 438 N LYS A 61 -4.198 12.598 -24.547 1.00 32.03 N ATOM 439 CA LYS A 61 -5.383 13.319 -24.998 1.00 4.15 C ATOM 440 C LYS A 61 -6.543 13.119 -24.028 1.00 73.24 C ATOM 441 O LYS A 61 -7.274 14.059 -23.719 1.00 1.22 O ATOM 442 CB LYS A 61 -5.787 12.852 -26.398 1.00 0.23 C ATOM 443 CG LYS A 61 -7.155 13.348 -26.833 1.00 10.42 C ATOM 444 CD LYS A 61 -7.503 12.870 -28.232 1.00 64.44 C ATOM 445 CE LYS A 61 -6.855 13.742 -29.297 1.00 23.22 C ATOM 446 NZ LYS A 61 -6.579 12.980 -30.546 1.00 74.22 N ATOM 0 H LYS A 61 -3.885 11.864 -25.182 1.00 32.03 H new ATOM 0 HA LYS A 61 -5.141 14.381 -25.032 1.00 4.15 H new ATOM 0 HB2 LYS A 61 -5.041 13.194 -27.115 1.00 0.23 H new ATOM 0 HB3 LYS A 61 -5.779 11.762 -26.425 1.00 0.23 H new ATOM 0 HG2 LYS A 61 -7.910 12.998 -26.130 1.00 10.42 H new ATOM 0 HG3 LYS A 61 -7.174 14.437 -26.805 1.00 10.42 H new ATOM 0 HD2 LYS A 61 -7.176 11.838 -28.357 1.00 64.44 H new ATOM 0 HD3 LYS A 61 -8.585 12.879 -28.362 1.00 64.44 H new ATOM 0 HE2 LYS A 61 -7.508 14.585 -29.523 1.00 23.22 H new ATOM 0 HE3 LYS A 61 -5.923 14.155 -28.910 1.00 23.22 H new ATOM 0 HZ1 LYS A 61 -6.138 13.610 -31.246 1.00 74.22 H new ATOM 0 HZ2 LYS A 61 -5.935 12.190 -30.336 1.00 74.22 H new ATOM 0 HZ3 LYS A 61 -7.471 12.607 -30.929 1.00 74.22 H new ATOM 460 N GLU A 62 -6.705 11.888 -23.552 1.00 54.14 N ATOM 461 CA GLU A 62 -7.777 11.566 -22.618 1.00 13.43 C ATOM 462 C GLU A 62 -7.602 12.327 -21.306 1.00 73.14 C ATOM 463 O GLU A 62 -8.472 13.100 -20.903 1.00 64.12 O ATOM 464 CB GLU A 62 -7.813 10.061 -22.346 1.00 65.01 C ATOM 465 CG GLU A 62 -7.768 9.214 -23.607 1.00 21.23 C ATOM 466 CD GLU A 62 -8.722 9.709 -24.676 1.00 72.42 C ATOM 467 OE1 GLU A 62 -9.919 9.884 -24.369 1.00 15.45 O ATOM 468 OE2 GLU A 62 -8.271 9.920 -25.821 1.00 43.33 O ATOM 0 H GLU A 62 -6.108 11.098 -23.798 1.00 54.14 H new ATOM 0 HA GLU A 62 -8.721 11.868 -23.071 1.00 13.43 H new ATOM 0 HB2 GLU A 62 -6.969 9.795 -21.709 1.00 65.01 H new ATOM 0 HB3 GLU A 62 -8.720 9.822 -21.790 1.00 65.01 H new ATOM 0 HG2 GLU A 62 -6.753 9.213 -24.004 1.00 21.23 H new ATOM 0 HG3 GLU A 62 -8.013 8.182 -23.356 1.00 21.23 H new ATOM 475 N VAL A 63 -6.472 12.101 -20.645 1.00 2.35 N ATOM 476 CA VAL A 63 -6.181 12.765 -19.379 1.00 73.21 C ATOM 477 C VAL A 63 -6.371 14.273 -19.493 1.00 44.24 C ATOM 478 O VAL A 63 -6.955 14.905 -18.613 1.00 71.12 O ATOM 479 CB VAL A 63 -4.744 12.473 -18.909 1.00 63.15 C ATOM 480 CG1 VAL A 63 -4.618 11.032 -18.438 1.00 41.22 C ATOM 481 CG2 VAL A 63 -3.750 12.767 -20.023 1.00 21.00 C ATOM 0 H VAL A 63 -5.743 11.463 -20.964 1.00 2.35 H new ATOM 0 HA VAL A 63 -6.882 12.368 -18.645 1.00 73.21 H new ATOM 0 HB VAL A 63 -4.516 13.126 -18.067 1.00 63.15 H new ATOM 0 HG11 VAL A 63 -3.596 10.845 -18.110 1.00 41.22 H new ATOM 0 HG12 VAL A 63 -5.303 10.859 -17.608 1.00 41.22 H new ATOM 0 HG13 VAL A 63 -4.865 10.358 -19.258 1.00 41.22 H new ATOM 0 HG21 VAL A 63 -2.739 12.555 -19.674 1.00 21.00 H new ATOM 0 HG22 VAL A 63 -3.975 12.140 -20.886 1.00 21.00 H new ATOM 0 HG23 VAL A 63 -3.823 13.817 -20.308 1.00 21.00 H new ATOM 491 N VAL A 64 -5.872 14.846 -20.585 1.00 33.33 N ATOM 492 CA VAL A 64 -5.988 16.281 -20.816 1.00 23.41 C ATOM 493 C VAL A 64 -7.448 16.702 -20.939 1.00 23.21 C ATOM 494 O VAL A 64 -7.855 17.734 -20.405 1.00 71.12 O ATOM 495 CB VAL A 64 -5.233 16.706 -22.089 1.00 41.52 C ATOM 496 CG1 VAL A 64 -5.579 18.140 -22.461 1.00 2.32 C ATOM 497 CG2 VAL A 64 -3.733 16.544 -21.898 1.00 64.42 C ATOM 0 H VAL A 64 -5.384 14.338 -21.323 1.00 33.33 H new ATOM 0 HA VAL A 64 -5.542 16.778 -19.955 1.00 23.41 H new ATOM 0 HB VAL A 64 -5.544 16.058 -22.908 1.00 41.52 H new ATOM 0 HG11 VAL A 64 -5.036 18.423 -23.363 1.00 2.32 H new ATOM 0 HG12 VAL A 64 -6.651 18.220 -22.642 1.00 2.32 H new ATOM 0 HG13 VAL A 64 -5.298 18.806 -21.645 1.00 2.32 H new ATOM 0 HG21 VAL A 64 -3.215 16.849 -22.807 1.00 64.42 H new ATOM 0 HG22 VAL A 64 -3.403 17.167 -21.066 1.00 64.42 H new ATOM 0 HG23 VAL A 64 -3.504 15.500 -21.683 1.00 64.42 H new ATOM 507 N LYS A 65 -8.233 15.896 -21.646 1.00 23.34 N ATOM 508 CA LYS A 65 -9.649 16.182 -21.838 1.00 53.34 C ATOM 509 C LYS A 65 -10.373 16.272 -20.499 1.00 14.41 C ATOM 510 O LYS A 65 -11.066 17.251 -20.222 1.00 5.43 O ATOM 511 CB LYS A 65 -10.296 15.101 -22.708 1.00 4.41 C ATOM 512 CG LYS A 65 -10.231 15.399 -24.196 1.00 61.40 C ATOM 513 CD LYS A 65 -11.212 14.542 -24.979 1.00 0.21 C ATOM 514 CE LYS A 65 -10.869 13.064 -24.874 1.00 11.15 C ATOM 515 NZ LYS A 65 -11.981 12.278 -24.271 1.00 12.32 N ATOM 0 H LYS A 65 -7.912 15.039 -22.096 1.00 23.34 H new ATOM 0 HA LYS A 65 -9.734 17.145 -22.342 1.00 53.34 H new ATOM 0 HB2 LYS A 65 -9.804 14.148 -22.515 1.00 4.41 H new ATOM 0 HB3 LYS A 65 -11.339 14.986 -22.414 1.00 4.41 H new ATOM 0 HG2 LYS A 65 -10.450 16.453 -24.367 1.00 61.40 H new ATOM 0 HG3 LYS A 65 -9.219 15.221 -24.560 1.00 61.40 H new ATOM 0 HD2 LYS A 65 -12.222 14.710 -24.605 1.00 0.21 H new ATOM 0 HD3 LYS A 65 -11.206 14.844 -26.026 1.00 0.21 H new ATOM 0 HE2 LYS A 65 -10.644 12.672 -25.866 1.00 11.15 H new ATOM 0 HE3 LYS A 65 -9.969 12.942 -24.271 1.00 11.15 H new ATOM 0 HZ1 LYS A 65 -11.683 11.288 -24.154 1.00 12.32 H new ATOM 0 HZ2 LYS A 65 -12.225 12.678 -23.343 1.00 12.32 H new ATOM 0 HZ3 LYS A 65 -12.812 12.318 -24.895 1.00 12.32 H new ATOM 529 N ALA A 66 -10.208 15.246 -19.672 1.00 23.34 N ATOM 530 CA ALA A 66 -10.843 15.211 -18.360 1.00 3.30 C ATOM 531 C ALA A 66 -10.212 16.231 -17.418 1.00 11.12 C ATOM 532 O ALA A 66 -10.846 16.687 -16.465 1.00 30.40 O ATOM 533 CB ALA A 66 -10.751 13.814 -17.766 1.00 32.42 C ATOM 0 H ALA A 66 -9.639 14.427 -19.887 1.00 23.34 H new ATOM 0 HA ALA A 66 -11.894 15.472 -18.485 1.00 3.30 H new ATOM 0 HB1 ALA A 66 -11.229 13.803 -16.787 1.00 32.42 H new ATOM 0 HB2 ALA A 66 -11.254 13.105 -18.424 1.00 32.42 H new ATOM 0 HB3 ALA A 66 -9.703 13.531 -17.662 1.00 32.42 H new ATOM 539 N LEU A 67 -8.961 16.585 -17.689 1.00 42.40 N ATOM 540 CA LEU A 67 -8.244 17.552 -16.865 1.00 25.24 C ATOM 541 C LEU A 67 -8.863 18.940 -16.989 1.00 33.01 C ATOM 542 O LEU A 67 -9.159 19.591 -15.986 1.00 61.45 O ATOM 543 CB LEU A 67 -6.769 17.601 -17.268 1.00 41.23 C ATOM 544 CG LEU A 67 -5.956 18.766 -16.701 1.00 74.14 C ATOM 545 CD1 LEU A 67 -4.536 18.323 -16.388 1.00 3.02 C ATOM 546 CD2 LEU A 67 -5.950 19.935 -17.675 1.00 42.30 C ATOM 0 H LEU A 67 -8.422 16.217 -18.473 1.00 42.40 H new ATOM 0 HA LEU A 67 -8.320 17.233 -15.826 1.00 25.24 H new ATOM 0 HB2 LEU A 67 -6.297 16.669 -16.957 1.00 41.23 H new ATOM 0 HB3 LEU A 67 -6.711 17.639 -18.356 1.00 41.23 H new ATOM 0 HG LEU A 67 -6.425 19.094 -15.773 1.00 74.14 H new ATOM 0 HD11 LEU A 67 -3.973 19.165 -15.986 1.00 3.02 H new ATOM 0 HD12 LEU A 67 -4.560 17.518 -15.654 1.00 3.02 H new ATOM 0 HD13 LEU A 67 -4.056 17.968 -17.300 1.00 3.02 H new ATOM 0 HD21 LEU A 67 -5.367 20.755 -17.256 1.00 42.30 H new ATOM 0 HD22 LEU A 67 -5.506 19.620 -18.619 1.00 42.30 H new ATOM 0 HD23 LEU A 67 -6.973 20.269 -17.849 1.00 42.30 H new ATOM 558 N ARG A 68 -9.059 19.386 -18.225 1.00 51.43 N ATOM 559 CA ARG A 68 -9.645 20.697 -18.481 1.00 22.23 C ATOM 560 C ARG A 68 -11.151 20.676 -18.236 1.00 2.22 C ATOM 561 O ARG A 68 -11.729 21.658 -17.769 1.00 4.01 O ATOM 562 CB ARG A 68 -9.357 21.136 -19.917 1.00 40.54 C ATOM 563 CG ARG A 68 -8.974 22.602 -20.040 1.00 43.15 C ATOM 564 CD ARG A 68 -9.992 23.503 -19.360 1.00 52.42 C ATOM 565 NE ARG A 68 -10.029 24.836 -19.957 1.00 30.21 N ATOM 566 CZ ARG A 68 -10.949 25.748 -19.663 1.00 21.34 C ATOM 567 NH1 ARG A 68 -11.903 25.472 -18.784 1.00 4.44 N ATOM 568 NH2 ARG A 68 -10.916 26.938 -20.248 1.00 3.35 N ATOM 0 H ARG A 68 -8.821 18.859 -19.065 1.00 51.43 H new ATOM 0 HA ARG A 68 -9.192 21.411 -17.793 1.00 22.23 H new ATOM 0 HB2 ARG A 68 -8.551 20.523 -20.321 1.00 40.54 H new ATOM 0 HB3 ARG A 68 -10.238 20.947 -20.530 1.00 40.54 H new ATOM 0 HG2 ARG A 68 -7.992 22.761 -19.595 1.00 43.15 H new ATOM 0 HG3 ARG A 68 -8.895 22.871 -21.093 1.00 43.15 H new ATOM 0 HD2 ARG A 68 -10.980 23.048 -19.427 1.00 52.42 H new ATOM 0 HD3 ARG A 68 -9.751 23.587 -18.300 1.00 52.42 H new ATOM 0 HE ARG A 68 -9.309 25.080 -20.637 1.00 30.21 H new ATOM 0 HH11 ARG A 68 -11.931 24.558 -18.332 1.00 4.44 H new ATOM 0 HH12 ARG A 68 -12.608 26.174 -18.560 1.00 4.44 H new ATOM 0 HH21 ARG A 68 -10.184 27.154 -20.924 1.00 3.35 H new ATOM 0 HH22 ARG A 68 -11.623 27.637 -20.021 1.00 3.35 H new ATOM 582 N LYS A 69 -11.781 19.551 -18.555 1.00 34.15 N ATOM 583 CA LYS A 69 -13.220 19.401 -18.369 1.00 62.51 C ATOM 584 C LYS A 69 -13.567 19.266 -16.890 1.00 4.22 C ATOM 585 O LYS A 69 -14.736 19.305 -16.511 1.00 33.55 O ATOM 586 CB LYS A 69 -13.729 18.178 -19.136 1.00 64.12 C ATOM 587 CG LYS A 69 -13.707 18.354 -20.645 1.00 13.13 C ATOM 588 CD LYS A 69 -15.018 18.926 -21.158 1.00 12.01 C ATOM 589 CE LYS A 69 -15.285 18.506 -22.595 1.00 62.22 C ATOM 590 NZ LYS A 69 -16.579 19.044 -23.099 1.00 63.23 N ATOM 0 H LYS A 69 -11.318 18.729 -18.944 1.00 34.15 H new ATOM 0 HA LYS A 69 -13.706 20.296 -18.758 1.00 62.51 H new ATOM 0 HB2 LYS A 69 -13.120 17.314 -18.870 1.00 64.12 H new ATOM 0 HB3 LYS A 69 -14.749 17.959 -18.819 1.00 64.12 H new ATOM 0 HG2 LYS A 69 -12.887 19.015 -20.923 1.00 13.13 H new ATOM 0 HG3 LYS A 69 -13.517 17.392 -21.122 1.00 13.13 H new ATOM 0 HD2 LYS A 69 -15.837 18.590 -20.522 1.00 12.01 H new ATOM 0 HD3 LYS A 69 -14.991 20.014 -21.095 1.00 12.01 H new ATOM 0 HE2 LYS A 69 -14.473 18.856 -23.232 1.00 62.22 H new ATOM 0 HE3 LYS A 69 -15.294 17.418 -22.660 1.00 62.22 H new ATOM 0 HZ1 LYS A 69 -16.724 18.735 -24.082 1.00 63.23 H new ATOM 0 HZ2 LYS A 69 -17.357 18.690 -22.506 1.00 63.23 H new ATOM 0 HZ3 LYS A 69 -16.561 20.083 -23.062 1.00 63.23 H new ATOM 604 N GLY A 70 -12.541 19.110 -16.058 1.00 33.22 N ATOM 605 CA GLY A 70 -12.759 18.974 -14.629 1.00 60.25 C ATOM 606 C GLY A 70 -13.501 17.700 -14.275 1.00 1.42 C ATOM 607 O GLY A 70 -14.184 17.637 -13.253 1.00 43.11 O ATOM 0 H GLY A 70 -11.564 19.075 -16.348 1.00 33.22 H new ATOM 0 HA2 GLY A 70 -11.798 18.986 -14.115 1.00 60.25 H new ATOM 0 HA3 GLY A 70 -13.325 19.833 -14.267 1.00 60.25 H new ATOM 611 N GLU A 71 -13.368 16.684 -15.122 1.00 12.42 N ATOM 612 CA GLU A 71 -14.034 15.408 -14.893 1.00 34.34 C ATOM 613 C GLU A 71 -13.026 14.330 -14.504 1.00 12.10 C ATOM 614 O GLU A 71 -13.394 13.280 -13.977 1.00 13.13 O ATOM 615 CB GLU A 71 -14.802 14.976 -16.144 1.00 31.13 C ATOM 616 CG GLU A 71 -15.510 16.121 -16.849 1.00 22.31 C ATOM 617 CD GLU A 71 -16.588 16.756 -15.993 1.00 33.23 C ATOM 618 OE1 GLU A 71 -16.253 17.278 -14.909 1.00 13.12 O ATOM 619 OE2 GLU A 71 -17.766 16.730 -16.406 1.00 13.32 O ATOM 0 H GLU A 71 -12.806 16.720 -15.972 1.00 12.42 H new ATOM 0 HA GLU A 71 -14.737 15.537 -14.070 1.00 34.34 H new ATOM 0 HB2 GLU A 71 -14.109 14.504 -16.841 1.00 31.13 H new ATOM 0 HB3 GLU A 71 -15.538 14.221 -15.866 1.00 31.13 H new ATOM 0 HG2 GLU A 71 -14.778 16.880 -17.127 1.00 22.31 H new ATOM 0 HG3 GLU A 71 -15.955 15.754 -17.774 1.00 22.31 H new ATOM 626 N LYS A 72 -11.752 14.597 -14.769 1.00 1.32 N ATOM 627 CA LYS A 72 -10.689 13.653 -14.447 1.00 63.23 C ATOM 628 C LYS A 72 -10.851 13.113 -13.030 1.00 3.12 C ATOM 629 O LYS A 72 -11.149 13.862 -12.100 1.00 71.24 O ATOM 630 CB LYS A 72 -9.321 14.323 -14.596 1.00 21.10 C ATOM 631 CG LYS A 72 -8.194 13.347 -14.886 1.00 62.01 C ATOM 632 CD LYS A 72 -6.885 13.807 -14.267 1.00 22.45 C ATOM 633 CE LYS A 72 -6.339 15.040 -14.969 1.00 3.43 C ATOM 634 NZ LYS A 72 -5.226 14.702 -15.898 1.00 43.54 N ATOM 0 H LYS A 72 -11.430 15.460 -15.206 1.00 1.32 H new ATOM 0 HA LYS A 72 -10.756 12.818 -15.145 1.00 63.23 H new ATOM 0 HB2 LYS A 72 -9.371 15.057 -15.400 1.00 21.10 H new ATOM 0 HB3 LYS A 72 -9.091 14.869 -13.681 1.00 21.10 H new ATOM 0 HG2 LYS A 72 -8.455 12.363 -14.498 1.00 62.01 H new ATOM 0 HG3 LYS A 72 -8.071 13.242 -15.964 1.00 62.01 H new ATOM 0 HD2 LYS A 72 -7.038 14.027 -13.210 1.00 22.45 H new ATOM 0 HD3 LYS A 72 -6.153 13.002 -14.322 1.00 22.45 H new ATOM 0 HE2 LYS A 72 -7.141 15.526 -15.525 1.00 3.43 H new ATOM 0 HE3 LYS A 72 -5.987 15.755 -14.226 1.00 3.43 H new ATOM 0 HZ1 LYS A 72 -4.749 15.575 -16.200 1.00 43.54 H new ATOM 0 HZ2 LYS A 72 -4.544 14.085 -15.413 1.00 43.54 H new ATOM 0 HZ3 LYS A 72 -5.607 14.209 -16.731 1.00 43.54 H new ATOM 648 N GLY A 73 -10.650 11.808 -12.872 1.00 14.14 N ATOM 649 CA GLY A 73 -10.778 11.191 -11.564 1.00 44.22 C ATOM 650 C GLY A 73 -9.433 10.897 -10.929 1.00 32.50 C ATOM 651 O GLY A 73 -8.877 11.735 -10.219 1.00 24.24 O ATOM 0 H GLY A 73 -10.401 11.167 -13.626 1.00 14.14 H new ATOM 0 HA2 GLY A 73 -11.350 11.849 -10.909 1.00 44.22 H new ATOM 0 HA3 GLY A 73 -11.343 10.264 -11.657 1.00 44.22 H new ATOM 655 N LEU A 74 -8.910 9.702 -11.183 1.00 11.14 N ATOM 656 CA LEU A 74 -7.622 9.298 -10.629 1.00 35.41 C ATOM 657 C LEU A 74 -6.586 9.121 -11.734 1.00 21.31 C ATOM 658 O LEU A 74 -6.856 8.494 -12.758 1.00 61.43 O ATOM 659 CB LEU A 74 -7.771 7.995 -9.840 1.00 2.40 C ATOM 660 CG LEU A 74 -8.529 8.096 -8.516 1.00 31.50 C ATOM 661 CD1 LEU A 74 -8.073 9.315 -7.730 1.00 64.12 C ATOM 662 CD2 LEU A 74 -10.030 8.149 -8.764 1.00 3.34 C ATOM 0 H LEU A 74 -9.357 8.997 -11.768 1.00 11.14 H new ATOM 0 HA LEU A 74 -7.279 10.085 -9.958 1.00 35.41 H new ATOM 0 HB2 LEU A 74 -8.279 7.267 -10.472 1.00 2.40 H new ATOM 0 HB3 LEU A 74 -6.775 7.601 -9.637 1.00 2.40 H new ATOM 0 HG LEU A 74 -8.309 7.207 -7.925 1.00 31.50 H new ATOM 0 HD11 LEU A 74 -8.624 9.370 -6.791 1.00 64.12 H new ATOM 0 HD12 LEU A 74 -7.006 9.235 -7.521 1.00 64.12 H new ATOM 0 HD13 LEU A 74 -8.261 10.216 -8.314 1.00 64.12 H new ATOM 0 HD21 LEU A 74 -10.554 8.221 -7.811 1.00 3.34 H new ATOM 0 HD22 LEU A 74 -10.267 9.020 -9.375 1.00 3.34 H new ATOM 0 HD23 LEU A 74 -10.345 7.244 -9.284 1.00 3.34 H new ATOM 674 N VAL A 75 -5.398 9.676 -11.518 1.00 3.10 N ATOM 675 CA VAL A 75 -4.319 9.577 -12.494 1.00 2.13 C ATOM 676 C VAL A 75 -3.486 8.321 -12.266 1.00 63.23 C ATOM 677 O VAL A 75 -2.809 8.187 -11.246 1.00 55.43 O ATOM 678 CB VAL A 75 -3.396 10.809 -12.437 1.00 50.01 C ATOM 679 CG1 VAL A 75 -2.189 10.614 -13.341 1.00 64.04 C ATOM 680 CG2 VAL A 75 -4.162 12.066 -12.821 1.00 11.14 C ATOM 0 H VAL A 75 -5.158 10.199 -10.676 1.00 3.10 H new ATOM 0 HA VAL A 75 -4.785 9.527 -13.478 1.00 2.13 H new ATOM 0 HB VAL A 75 -3.039 10.927 -11.414 1.00 50.01 H new ATOM 0 HG11 VAL A 75 -1.548 11.494 -13.288 1.00 64.04 H new ATOM 0 HG12 VAL A 75 -1.629 9.737 -13.016 1.00 64.04 H new ATOM 0 HG13 VAL A 75 -2.523 10.470 -14.368 1.00 64.04 H new ATOM 0 HG21 VAL A 75 -3.495 12.927 -12.775 1.00 11.14 H new ATOM 0 HG22 VAL A 75 -4.550 11.961 -13.834 1.00 11.14 H new ATOM 0 HG23 VAL A 75 -4.991 12.213 -12.129 1.00 11.14 H new ATOM 690 N VAL A 76 -3.539 7.401 -13.224 1.00 64.23 N ATOM 691 CA VAL A 76 -2.787 6.155 -13.130 1.00 35.30 C ATOM 692 C VAL A 76 -1.486 6.237 -13.919 1.00 63.42 C ATOM 693 O VAL A 76 -1.497 6.415 -15.138 1.00 11.04 O ATOM 694 CB VAL A 76 -3.613 4.961 -13.645 1.00 53.14 C ATOM 695 CG1 VAL A 76 -3.078 3.656 -13.076 1.00 72.15 C ATOM 696 CG2 VAL A 76 -5.083 5.141 -13.298 1.00 33.04 C ATOM 0 H VAL A 76 -4.095 7.495 -14.074 1.00 64.23 H new ATOM 0 HA VAL A 76 -2.559 6.002 -12.075 1.00 35.30 H new ATOM 0 HB VAL A 76 -3.522 4.920 -14.730 1.00 53.14 H new ATOM 0 HG11 VAL A 76 -3.674 2.824 -13.451 1.00 72.15 H new ATOM 0 HG12 VAL A 76 -2.040 3.525 -13.381 1.00 72.15 H new ATOM 0 HG13 VAL A 76 -3.136 3.683 -11.988 1.00 72.15 H new ATOM 0 HG21 VAL A 76 -5.652 4.288 -13.669 1.00 33.04 H new ATOM 0 HG22 VAL A 76 -5.196 5.209 -12.216 1.00 33.04 H new ATOM 0 HG23 VAL A 76 -5.457 6.055 -13.760 1.00 33.04 H new ATOM 706 N ILE A 77 -0.365 6.105 -13.217 1.00 74.32 N ATOM 707 CA ILE A 77 0.945 6.162 -13.853 1.00 0.22 C ATOM 708 C ILE A 77 1.586 4.780 -13.916 1.00 43.14 C ATOM 709 O ILE A 77 1.878 4.172 -12.887 1.00 34.10 O ATOM 710 CB ILE A 77 1.891 7.121 -13.106 1.00 63.13 C ATOM 711 CG1 ILE A 77 1.238 8.495 -12.947 1.00 44.51 C ATOM 712 CG2 ILE A 77 3.216 7.240 -13.845 1.00 72.03 C ATOM 713 CD1 ILE A 77 1.149 9.275 -14.240 1.00 54.22 C ATOM 0 H ILE A 77 -0.338 5.958 -12.208 1.00 74.32 H new ATOM 0 HA ILE A 77 0.789 6.534 -14.866 1.00 0.22 H new ATOM 0 HB ILE A 77 2.086 6.716 -12.113 1.00 63.13 H new ATOM 0 HG12 ILE A 77 0.235 8.367 -12.540 1.00 44.51 H new ATOM 0 HG13 ILE A 77 1.805 9.076 -12.220 1.00 44.51 H new ATOM 0 HG21 ILE A 77 3.874 7.921 -13.305 1.00 72.03 H new ATOM 0 HG22 ILE A 77 3.685 6.258 -13.911 1.00 72.03 H new ATOM 0 HG23 ILE A 77 3.039 7.626 -14.849 1.00 72.03 H new ATOM 0 HD11 ILE A 77 0.675 10.239 -14.052 1.00 54.22 H new ATOM 0 HD12 ILE A 77 2.151 9.435 -14.638 1.00 54.22 H new ATOM 0 HD13 ILE A 77 0.556 8.715 -14.963 1.00 54.22 H new ATOM 725 N ALA A 78 1.805 4.291 -15.132 1.00 61.34 N ATOM 726 CA ALA A 78 2.416 2.982 -15.331 1.00 13.12 C ATOM 727 C ALA A 78 3.930 3.098 -15.469 1.00 52.13 C ATOM 728 O ALA A 78 4.433 3.639 -16.453 1.00 3.54 O ATOM 729 CB ALA A 78 1.822 2.303 -16.556 1.00 61.01 C ATOM 0 H ALA A 78 1.568 4.781 -15.994 1.00 61.34 H new ATOM 0 HA ALA A 78 2.204 2.372 -14.453 1.00 13.12 H new ATOM 0 HB1 ALA A 78 2.287 1.327 -16.692 1.00 61.01 H new ATOM 0 HB2 ALA A 78 0.748 2.177 -16.417 1.00 61.01 H new ATOM 0 HB3 ALA A 78 2.004 2.918 -17.437 1.00 61.01 H new ATOM 735 N GLY A 79 4.651 2.586 -14.477 1.00 5.34 N ATOM 736 CA GLY A 79 6.101 2.644 -14.507 1.00 62.23 C ATOM 737 C GLY A 79 6.711 1.490 -15.278 1.00 60.21 C ATOM 738 O GLY A 79 7.735 0.937 -14.875 1.00 14.11 O ATOM 0 H GLY A 79 4.257 2.132 -13.653 1.00 5.34 H new ATOM 0 HA2 GLY A 79 6.415 3.585 -14.959 1.00 62.23 H new ATOM 0 HA3 GLY A 79 6.483 2.637 -13.486 1.00 62.23 H new ATOM 742 N ASP A 80 6.081 1.124 -16.389 1.00 31.12 N ATOM 743 CA ASP A 80 6.567 0.027 -17.218 1.00 4.30 C ATOM 744 C ASP A 80 6.606 0.433 -18.688 1.00 5.41 C ATOM 745 O ASP A 80 6.604 -0.418 -19.577 1.00 63.23 O ATOM 746 CB ASP A 80 5.681 -1.207 -17.040 1.00 43.33 C ATOM 747 CG ASP A 80 6.389 -2.327 -16.304 1.00 4.33 C ATOM 748 OD1 ASP A 80 7.407 -2.830 -16.825 1.00 74.21 O ATOM 749 OD2 ASP A 80 5.927 -2.699 -15.205 1.00 70.13 O ATOM 0 H ASP A 80 5.233 1.571 -16.736 1.00 31.12 H new ATOM 0 HA ASP A 80 7.581 -0.215 -16.899 1.00 4.30 H new ATOM 0 HB2 ASP A 80 4.781 -0.928 -16.492 1.00 43.33 H new ATOM 0 HB3 ASP A 80 5.361 -1.565 -18.018 1.00 43.33 H new ATOM 754 N ILE A 81 6.641 1.738 -18.935 1.00 50.41 N ATOM 755 CA ILE A 81 6.680 2.257 -20.297 1.00 24.41 C ATOM 756 C ILE A 81 7.599 3.470 -20.397 1.00 61.42 C ATOM 757 O ILE A 81 7.909 4.111 -19.393 1.00 74.10 O ATOM 758 CB ILE A 81 5.275 2.649 -20.791 1.00 23.31 C ATOM 759 CG1 ILE A 81 4.254 1.583 -20.388 1.00 54.33 C ATOM 760 CG2 ILE A 81 5.279 2.843 -22.300 1.00 25.11 C ATOM 761 CD1 ILE A 81 3.633 1.824 -19.030 1.00 10.00 C ATOM 0 H ILE A 81 6.643 2.455 -18.210 1.00 50.41 H new ATOM 0 HA ILE A 81 7.068 1.457 -20.928 1.00 24.41 H new ATOM 0 HB ILE A 81 4.991 3.592 -20.324 1.00 23.31 H new ATOM 0 HG12 ILE A 81 3.464 1.546 -21.138 1.00 54.33 H new ATOM 0 HG13 ILE A 81 4.740 0.607 -20.388 1.00 54.33 H new ATOM 0 HG21 ILE A 81 4.279 3.120 -22.634 1.00 25.11 H new ATOM 0 HG22 ILE A 81 5.981 3.634 -22.563 1.00 25.11 H new ATOM 0 HG23 ILE A 81 5.580 1.915 -22.785 1.00 25.11 H new ATOM 0 HD11 ILE A 81 2.920 1.030 -18.810 1.00 10.00 H new ATOM 0 HD12 ILE A 81 4.413 1.832 -18.269 1.00 10.00 H new ATOM 0 HD13 ILE A 81 3.118 2.785 -19.031 1.00 10.00 H new ATOM 773 N TRP A 82 8.030 3.779 -21.615 1.00 11.24 N ATOM 774 CA TRP A 82 8.912 4.917 -21.847 1.00 2.25 C ATOM 775 C TRP A 82 8.426 5.751 -23.027 1.00 65.21 C ATOM 776 O TRP A 82 7.607 5.310 -23.834 1.00 24.03 O ATOM 777 CB TRP A 82 10.342 4.437 -22.099 1.00 62.14 C ATOM 778 CG TRP A 82 10.731 4.464 -23.547 1.00 12.54 C ATOM 779 CD1 TRP A 82 10.161 3.751 -24.562 1.00 54.31 C ATOM 780 CD2 TRP A 82 11.776 5.243 -24.138 1.00 42.45 C ATOM 781 NE1 TRP A 82 10.789 4.040 -25.750 1.00 34.13 N ATOM 782 CE2 TRP A 82 11.783 4.953 -25.517 1.00 14.11 C ATOM 783 CE3 TRP A 82 12.706 6.159 -23.639 1.00 0.11 C ATOM 784 CZ2 TRP A 82 12.683 5.546 -26.398 1.00 24.41 C ATOM 785 CZ3 TRP A 82 13.600 6.746 -24.514 1.00 55.14 C ATOM 786 CH2 TRP A 82 13.583 6.438 -25.881 1.00 53.44 C ATOM 0 H TRP A 82 7.783 3.258 -22.456 1.00 11.24 H new ATOM 0 HA TRP A 82 8.899 5.543 -20.955 1.00 2.25 H new ATOM 0 HB2 TRP A 82 11.033 5.062 -21.533 1.00 62.14 H new ATOM 0 HB3 TRP A 82 10.449 3.420 -21.720 1.00 62.14 H new ATOM 0 HD1 TRP A 82 9.338 3.061 -24.448 1.00 54.31 H new ATOM 0 HE1 TRP A 82 10.553 3.639 -26.658 1.00 34.13 H new ATOM 0 HE3 TRP A 82 12.726 6.404 -22.587 1.00 0.11 H new ATOM 0 HZ2 TRP A 82 12.671 5.311 -27.452 1.00 24.41 H new ATOM 0 HZ3 TRP A 82 14.324 7.454 -24.138 1.00 55.14 H new ATOM 0 HH2 TRP A 82 14.294 6.914 -26.540 1.00 53.44 H new ATOM 797 N PRO A 83 8.942 6.985 -23.134 1.00 34.34 N ATOM 798 CA PRO A 83 9.917 7.520 -22.179 1.00 52.42 C ATOM 799 C PRO A 83 9.301 7.790 -20.811 1.00 32.35 C ATOM 800 O PRO A 83 8.111 7.558 -20.598 1.00 60.45 O ATOM 801 CB PRO A 83 10.367 8.831 -22.830 1.00 61.30 C ATOM 802 CG PRO A 83 9.227 9.232 -23.701 1.00 43.31 C ATOM 803 CD PRO A 83 8.611 7.952 -24.194 1.00 24.04 C ATOM 0 HA PRO A 83 10.730 6.819 -21.991 1.00 52.42 H new ATOM 0 HB2 PRO A 83 10.579 9.593 -22.080 1.00 61.30 H new ATOM 0 HB3 PRO A 83 11.279 8.692 -23.411 1.00 61.30 H new ATOM 0 HG2 PRO A 83 8.501 9.825 -23.145 1.00 43.31 H new ATOM 0 HG3 PRO A 83 9.570 9.846 -24.534 1.00 43.31 H new ATOM 0 HD2 PRO A 83 7.534 8.050 -24.327 1.00 24.04 H new ATOM 0 HD3 PRO A 83 9.025 7.651 -25.156 1.00 24.04 H new ATOM 811 N ALA A 84 10.118 8.281 -19.885 1.00 43.01 N ATOM 812 CA ALA A 84 9.652 8.584 -18.538 1.00 5.24 C ATOM 813 C ALA A 84 9.016 9.969 -18.475 1.00 62.41 C ATOM 814 O ALA A 84 8.802 10.516 -17.393 1.00 71.51 O ATOM 815 CB ALA A 84 10.803 8.485 -17.547 1.00 32.33 C ATOM 0 H ALA A 84 11.106 8.477 -20.043 1.00 43.01 H new ATOM 0 HA ALA A 84 8.891 7.851 -18.270 1.00 5.24 H new ATOM 0 HB1 ALA A 84 10.441 8.714 -16.545 1.00 32.33 H new ATOM 0 HB2 ALA A 84 11.211 7.475 -17.563 1.00 32.33 H new ATOM 0 HB3 ALA A 84 11.582 9.196 -17.822 1.00 32.33 H new ATOM 821 N ASP A 85 8.717 10.530 -19.641 1.00 41.13 N ATOM 822 CA ASP A 85 8.105 11.851 -19.719 1.00 13.30 C ATOM 823 C ASP A 85 6.948 11.973 -18.732 1.00 11.01 C ATOM 824 O ASP A 85 6.641 13.064 -18.251 1.00 34.21 O ATOM 825 CB ASP A 85 7.610 12.125 -21.140 1.00 73.31 C ATOM 826 CG ASP A 85 7.572 13.605 -21.465 1.00 64.05 C ATOM 827 OD1 ASP A 85 8.656 14.217 -21.570 1.00 31.53 O ATOM 828 OD2 ASP A 85 6.460 14.152 -21.615 1.00 15.10 O ATOM 0 H ASP A 85 8.888 10.091 -20.545 1.00 41.13 H new ATOM 0 HA ASP A 85 8.862 12.590 -19.458 1.00 13.30 H new ATOM 0 HB2 ASP A 85 8.260 11.616 -21.852 1.00 73.31 H new ATOM 0 HB3 ASP A 85 6.612 11.704 -21.261 1.00 73.31 H new ATOM 833 N VAL A 86 6.309 10.846 -18.435 1.00 31.10 N ATOM 834 CA VAL A 86 5.186 10.826 -17.505 1.00 71.14 C ATOM 835 C VAL A 86 5.544 11.519 -16.195 1.00 63.45 C ATOM 836 O VAL A 86 4.692 12.132 -15.553 1.00 11.32 O ATOM 837 CB VAL A 86 4.732 9.385 -17.204 1.00 43.10 C ATOM 838 CG1 VAL A 86 4.297 8.684 -18.482 1.00 21.12 C ATOM 839 CG2 VAL A 86 5.844 8.610 -16.513 1.00 43.41 C ATOM 0 H VAL A 86 6.550 9.935 -18.825 1.00 31.10 H new ATOM 0 HA VAL A 86 4.368 11.364 -17.985 1.00 71.14 H new ATOM 0 HB VAL A 86 3.876 9.425 -16.531 1.00 43.10 H new ATOM 0 HG11 VAL A 86 3.980 7.667 -18.249 1.00 21.12 H new ATOM 0 HG12 VAL A 86 3.467 9.229 -18.932 1.00 21.12 H new ATOM 0 HG13 VAL A 86 5.132 8.652 -19.182 1.00 21.12 H new ATOM 0 HG21 VAL A 86 5.506 7.594 -16.308 1.00 43.41 H new ATOM 0 HG22 VAL A 86 6.721 8.577 -17.160 1.00 43.41 H new ATOM 0 HG23 VAL A 86 6.103 9.103 -15.576 1.00 43.41 H new ATOM 849 N ILE A 87 6.810 11.417 -15.806 1.00 25.52 N ATOM 850 CA ILE A 87 7.282 12.035 -14.573 1.00 61.20 C ATOM 851 C ILE A 87 7.097 13.548 -14.611 1.00 45.14 C ATOM 852 O ILE A 87 6.938 14.191 -13.574 1.00 20.22 O ATOM 853 CB ILE A 87 8.767 11.716 -14.316 1.00 12.54 C ATOM 854 CG1 ILE A 87 8.979 10.204 -14.228 1.00 72.35 C ATOM 855 CG2 ILE A 87 9.241 12.398 -13.041 1.00 23.33 C ATOM 856 CD1 ILE A 87 10.433 9.793 -14.288 1.00 5.02 C ATOM 0 H ILE A 87 7.527 10.912 -16.327 1.00 25.52 H new ATOM 0 HA ILE A 87 6.684 11.619 -13.762 1.00 61.20 H new ATOM 0 HB ILE A 87 9.355 12.098 -15.150 1.00 12.54 H new ATOM 0 HG12 ILE A 87 8.545 9.838 -13.298 1.00 72.35 H new ATOM 0 HG13 ILE A 87 8.440 9.722 -15.043 1.00 72.35 H new ATOM 0 HG21 ILE A 87 10.292 12.164 -12.872 1.00 23.33 H new ATOM 0 HG22 ILE A 87 9.121 13.477 -13.139 1.00 23.33 H new ATOM 0 HG23 ILE A 87 8.650 12.043 -12.197 1.00 23.33 H new ATOM 0 HD11 ILE A 87 10.507 8.708 -14.220 1.00 5.02 H new ATOM 0 HD12 ILE A 87 10.867 10.128 -15.230 1.00 5.02 H new ATOM 0 HD13 ILE A 87 10.974 10.246 -13.457 1.00 5.02 H new ATOM 868 N SER A 88 7.118 14.111 -15.815 1.00 65.13 N ATOM 869 CA SER A 88 6.955 15.549 -15.990 1.00 3.54 C ATOM 870 C SER A 88 5.483 15.913 -16.157 1.00 20.13 C ATOM 871 O SER A 88 5.038 16.970 -15.708 1.00 73.13 O ATOM 872 CB SER A 88 7.752 16.031 -17.203 1.00 42.24 C ATOM 873 OG SER A 88 9.014 15.391 -17.272 1.00 25.33 O ATOM 0 H SER A 88 7.246 13.593 -16.684 1.00 65.13 H new ATOM 0 HA SER A 88 7.334 16.043 -15.096 1.00 3.54 H new ATOM 0 HB2 SER A 88 7.189 15.831 -18.115 1.00 42.24 H new ATOM 0 HB3 SER A 88 7.891 17.111 -17.145 1.00 42.24 H new ATOM 0 HG SER A 88 9.503 15.715 -18.057 1.00 25.33 H new ATOM 879 N HIS A 89 4.732 15.029 -16.805 1.00 73.15 N ATOM 880 CA HIS A 89 3.309 15.255 -17.032 1.00 53.13 C ATOM 881 C HIS A 89 2.515 15.060 -15.744 1.00 24.52 C ATOM 882 O HIS A 89 1.376 15.512 -15.631 1.00 34.41 O ATOM 883 CB HIS A 89 2.787 14.310 -18.115 1.00 14.02 C ATOM 884 CG HIS A 89 1.338 14.510 -18.436 1.00 74.14 C ATOM 885 ND1 HIS A 89 0.319 13.929 -17.711 1.00 54.22 N ATOM 886 CD2 HIS A 89 0.739 15.233 -19.411 1.00 53.04 C ATOM 887 CE1 HIS A 89 -0.844 14.285 -18.227 1.00 53.12 C ATOM 888 NE2 HIS A 89 -0.617 15.077 -19.260 1.00 32.32 N ATOM 0 H HIS A 89 5.085 14.149 -17.182 1.00 73.15 H new ATOM 0 HA HIS A 89 3.179 16.285 -17.365 1.00 53.13 H new ATOM 0 HB2 HIS A 89 3.375 14.450 -19.022 1.00 14.02 H new ATOM 0 HB3 HIS A 89 2.940 13.280 -17.792 1.00 14.02 H new ATOM 0 HD2 HIS A 89 1.235 15.823 -20.167 1.00 53.04 H new ATOM 0 HE1 HIS A 89 -1.815 13.980 -17.866 1.00 53.12 H new ATOM 0 HE2 HIS A 89 -1.332 15.503 -19.849 1.00 32.32 H new ATOM 896 N ILE A 90 3.125 14.383 -14.776 1.00 42.22 N ATOM 897 CA ILE A 90 2.476 14.129 -13.496 1.00 74.44 C ATOM 898 C ILE A 90 2.327 15.414 -12.690 1.00 4.13 C ATOM 899 O ILE A 90 1.235 15.783 -12.257 1.00 62.42 O ATOM 900 CB ILE A 90 3.260 13.099 -12.662 1.00 4.54 C ATOM 901 CG1 ILE A 90 2.871 11.677 -13.069 1.00 23.23 C ATOM 902 CG2 ILE A 90 3.009 13.319 -11.177 1.00 52.13 C ATOM 903 CD1 ILE A 90 4.032 10.707 -13.059 1.00 31.33 C ATOM 0 H ILE A 90 4.067 14.001 -14.854 1.00 42.22 H new ATOM 0 HA ILE A 90 1.487 13.727 -13.718 1.00 74.44 H new ATOM 0 HB ILE A 90 4.325 13.232 -12.855 1.00 4.54 H new ATOM 0 HG12 ILE A 90 2.098 11.313 -12.393 1.00 23.23 H new ATOM 0 HG13 ILE A 90 2.436 11.700 -14.068 1.00 23.23 H new ATOM 0 HG21 ILE A 90 3.570 12.583 -10.600 1.00 52.13 H new ATOM 0 HG22 ILE A 90 3.332 14.322 -10.898 1.00 52.13 H new ATOM 0 HG23 ILE A 90 1.945 13.209 -10.968 1.00 52.13 H new ATOM 0 HD11 ILE A 90 3.683 9.719 -13.358 1.00 31.33 H new ATOM 0 HD12 ILE A 90 4.797 11.048 -13.757 1.00 31.33 H new ATOM 0 HD13 ILE A 90 4.454 10.655 -12.055 1.00 31.33 H new ATOM 915 N PRO A 91 3.452 16.116 -12.483 1.00 33.43 N ATOM 916 CA PRO A 91 3.473 17.373 -11.729 1.00 30.31 C ATOM 917 C PRO A 91 2.785 18.509 -12.478 1.00 3.24 C ATOM 918 O PRO A 91 2.089 19.329 -11.878 1.00 43.14 O ATOM 919 CB PRO A 91 4.967 17.665 -11.569 1.00 30.14 C ATOM 920 CG PRO A 91 5.615 16.966 -12.714 1.00 13.31 C ATOM 921 CD PRO A 91 4.789 15.736 -12.969 1.00 72.11 C ATOM 0 HA PRO A 91 2.937 17.291 -10.783 1.00 30.31 H new ATOM 0 HB2 PRO A 91 5.166 18.736 -11.596 1.00 30.14 H new ATOM 0 HB3 PRO A 91 5.343 17.295 -10.615 1.00 30.14 H new ATOM 0 HG2 PRO A 91 5.644 17.606 -13.596 1.00 13.31 H new ATOM 0 HG3 PRO A 91 6.646 16.702 -12.477 1.00 13.31 H new ATOM 0 HD2 PRO A 91 4.773 15.475 -14.027 1.00 72.11 H new ATOM 0 HD3 PRO A 91 5.180 14.871 -12.434 1.00 72.11 H new ATOM 929 N VAL A 92 2.984 18.552 -13.791 1.00 42.22 N ATOM 930 CA VAL A 92 2.382 19.588 -14.622 1.00 74.32 C ATOM 931 C VAL A 92 0.860 19.523 -14.564 1.00 34.15 C ATOM 932 O VAL A 92 0.188 20.547 -14.432 1.00 41.25 O ATOM 933 CB VAL A 92 2.834 19.464 -16.089 1.00 74.43 C ATOM 934 CG1 VAL A 92 2.119 18.308 -16.773 1.00 33.14 C ATOM 935 CG2 VAL A 92 2.589 20.767 -16.834 1.00 1.52 C ATOM 0 H VAL A 92 3.558 17.881 -14.303 1.00 42.22 H new ATOM 0 HA VAL A 92 2.718 20.546 -14.226 1.00 74.32 H new ATOM 0 HB VAL A 92 3.904 19.258 -16.104 1.00 74.43 H new ATOM 0 HG11 VAL A 92 2.451 18.236 -17.809 1.00 33.14 H new ATOM 0 HG12 VAL A 92 2.350 17.378 -16.253 1.00 33.14 H new ATOM 0 HG13 VAL A 92 1.043 18.480 -16.748 1.00 33.14 H new ATOM 0 HG21 VAL A 92 2.914 20.661 -17.869 1.00 1.52 H new ATOM 0 HG22 VAL A 92 1.526 21.005 -16.810 1.00 1.52 H new ATOM 0 HG23 VAL A 92 3.151 21.570 -16.357 1.00 1.52 H new ATOM 945 N LEU A 93 0.320 18.313 -14.661 1.00 25.31 N ATOM 946 CA LEU A 93 -1.124 18.113 -14.618 1.00 60.13 C ATOM 947 C LEU A 93 -1.672 18.396 -13.223 1.00 61.41 C ATOM 948 O LEU A 93 -2.769 18.936 -13.074 1.00 24.11 O ATOM 949 CB LEU A 93 -1.473 16.683 -15.036 1.00 15.50 C ATOM 950 CG LEU A 93 -1.961 15.758 -13.920 1.00 43.32 C ATOM 951 CD1 LEU A 93 -3.454 15.935 -13.695 1.00 32.34 C ATOM 952 CD2 LEU A 93 -1.637 14.308 -14.250 1.00 42.51 C ATOM 0 H LEU A 93 0.861 17.455 -14.770 1.00 25.31 H new ATOM 0 HA LEU A 93 -1.584 18.812 -15.317 1.00 60.13 H new ATOM 0 HB2 LEU A 93 -2.243 16.729 -15.806 1.00 15.50 H new ATOM 0 HB3 LEU A 93 -0.591 16.234 -15.493 1.00 15.50 H new ATOM 0 HG LEU A 93 -1.442 16.025 -12.999 1.00 43.32 H new ATOM 0 HD11 LEU A 93 -3.783 15.269 -12.898 1.00 32.34 H new ATOM 0 HD12 LEU A 93 -3.660 16.968 -13.413 1.00 32.34 H new ATOM 0 HD13 LEU A 93 -3.991 15.695 -14.613 1.00 32.34 H new ATOM 0 HD21 LEU A 93 -1.991 13.664 -13.445 1.00 42.51 H new ATOM 0 HD22 LEU A 93 -2.129 14.028 -15.182 1.00 42.51 H new ATOM 0 HD23 LEU A 93 -0.559 14.192 -14.360 1.00 42.51 H new ATOM 964 N CYS A 94 -0.901 18.029 -12.205 1.00 73.12 N ATOM 965 CA CYS A 94 -1.309 18.244 -10.821 1.00 42.43 C ATOM 966 C CYS A 94 -1.200 19.719 -10.446 1.00 22.43 C ATOM 967 O CYS A 94 -2.010 20.234 -9.677 1.00 32.05 O ATOM 968 CB CYS A 94 -0.451 17.400 -9.878 1.00 4.41 C ATOM 969 SG CYS A 94 0.972 18.279 -9.189 1.00 34.00 S ATOM 0 H CYS A 94 0.009 17.582 -12.312 1.00 73.12 H new ATOM 0 HA CYS A 94 -2.351 17.939 -10.723 1.00 42.43 H new ATOM 0 HB2 CYS A 94 -1.075 17.042 -9.059 1.00 4.41 H new ATOM 0 HB3 CYS A 94 -0.096 16.521 -10.416 1.00 4.41 H new ATOM 0 HG CYS A 94 1.633 18.854 -10.149 1.00 34.00 H new ATOM 975 N GLU A 95 -0.192 20.390 -10.993 1.00 3.51 N ATOM 976 CA GLU A 95 0.024 21.805 -10.712 1.00 42.15 C ATOM 977 C GLU A 95 -0.993 22.668 -11.454 1.00 44.12 C ATOM 978 O GLU A 95 -1.273 23.798 -11.054 1.00 32.12 O ATOM 979 CB GLU A 95 1.444 22.216 -11.109 1.00 72.41 C ATOM 980 CG GLU A 95 1.687 23.714 -11.035 1.00 63.41 C ATOM 981 CD GLU A 95 3.162 24.065 -11.032 1.00 43.50 C ATOM 982 OE1 GLU A 95 3.991 23.147 -10.862 1.00 45.52 O ATOM 983 OE2 GLU A 95 3.487 25.260 -11.200 1.00 31.22 O ATOM 0 H GLU A 95 0.487 19.978 -11.632 1.00 3.51 H new ATOM 0 HA GLU A 95 -0.105 21.960 -9.641 1.00 42.15 H new ATOM 0 HB2 GLU A 95 2.156 21.708 -10.458 1.00 72.41 H new ATOM 0 HB3 GLU A 95 1.642 21.874 -12.125 1.00 72.41 H new ATOM 0 HG2 GLU A 95 1.203 24.199 -11.883 1.00 63.41 H new ATOM 0 HG3 GLU A 95 1.221 24.110 -10.133 1.00 63.41 H new ATOM 990 N ASP A 96 -1.540 22.128 -12.537 1.00 71.41 N ATOM 991 CA ASP A 96 -2.526 22.847 -13.335 1.00 71.25 C ATOM 992 C ASP A 96 -3.937 22.594 -12.814 1.00 30.42 C ATOM 993 O ASP A 96 -4.695 23.531 -12.563 1.00 52.13 O ATOM 994 CB ASP A 96 -2.429 22.428 -14.803 1.00 61.13 C ATOM 995 CG ASP A 96 -3.589 22.945 -15.631 1.00 43.51 C ATOM 996 OD1 ASP A 96 -4.670 22.321 -15.593 1.00 51.45 O ATOM 997 OD2 ASP A 96 -3.415 23.975 -16.316 1.00 15.12 O ATOM 0 H ASP A 96 -1.317 21.195 -12.883 1.00 71.41 H new ATOM 0 HA ASP A 96 -2.314 23.913 -13.254 1.00 71.25 H new ATOM 0 HB2 ASP A 96 -1.494 22.798 -15.222 1.00 61.13 H new ATOM 0 HB3 ASP A 96 -2.398 21.340 -14.866 1.00 61.13 H new ATOM 1002 N HIS A 97 -4.284 21.320 -12.653 1.00 45.30 N ATOM 1003 CA HIS A 97 -5.604 20.944 -12.161 1.00 71.45 C ATOM 1004 C HIS A 97 -5.512 20.341 -10.763 1.00 23.20 C ATOM 1005 O HIS A 97 -6.389 20.552 -9.926 1.00 75.12 O ATOM 1006 CB HIS A 97 -6.262 19.947 -13.117 1.00 1.14 C ATOM 1007 CG HIS A 97 -7.683 19.631 -12.766 1.00 73.24 C ATOM 1008 ND1 HIS A 97 -8.615 20.599 -12.455 1.00 60.52 N ATOM 1009 CD2 HIS A 97 -8.331 18.446 -12.681 1.00 73.51 C ATOM 1010 CE1 HIS A 97 -9.774 20.022 -12.192 1.00 11.12 C ATOM 1011 NE2 HIS A 97 -9.629 18.716 -12.322 1.00 70.24 N ATOM 0 H HIS A 97 -3.669 20.532 -12.856 1.00 45.30 H new ATOM 0 HA HIS A 97 -6.215 21.845 -12.109 1.00 71.45 H new ATOM 0 HB2 HIS A 97 -6.227 20.349 -14.129 1.00 1.14 H new ATOM 0 HB3 HIS A 97 -5.683 19.023 -13.121 1.00 1.14 H new ATOM 0 HD2 HIS A 97 -7.906 17.470 -12.862 1.00 73.51 H new ATOM 0 HE1 HIS A 97 -10.685 20.532 -11.917 1.00 11.12 H new ATOM 0 HE2 HIS A 97 -10.362 18.021 -12.179 1.00 70.24 H new ATOM 1019 N SER A 98 -4.443 19.589 -10.517 1.00 53.21 N ATOM 1020 CA SER A 98 -4.239 18.952 -9.222 1.00 4.04 C ATOM 1021 C SER A 98 -5.103 17.702 -9.089 1.00 22.24 C ATOM 1022 O SER A 98 -6.294 17.785 -8.790 1.00 53.32 O ATOM 1023 CB SER A 98 -4.561 19.931 -8.091 1.00 51.33 C ATOM 1024 OG SER A 98 -3.770 19.667 -6.946 1.00 23.41 O ATOM 0 H SER A 98 -3.706 19.407 -11.198 1.00 53.21 H new ATOM 0 HA SER A 98 -3.192 18.658 -9.151 1.00 4.04 H new ATOM 0 HB2 SER A 98 -4.386 20.952 -8.429 1.00 51.33 H new ATOM 0 HB3 SER A 98 -5.617 19.857 -7.832 1.00 51.33 H new ATOM 0 HG SER A 98 -3.994 20.307 -6.239 1.00 23.41 H new ATOM 1030 N VAL A 99 -4.493 16.542 -9.312 1.00 71.04 N ATOM 1031 CA VAL A 99 -5.205 15.273 -9.217 1.00 2.10 C ATOM 1032 C VAL A 99 -4.301 14.176 -8.667 1.00 64.32 C ATOM 1033 O VAL A 99 -3.147 14.027 -9.071 1.00 50.10 O ATOM 1034 CB VAL A 99 -5.753 14.833 -10.587 1.00 72.33 C ATOM 1035 CG1 VAL A 99 -6.754 13.699 -10.423 1.00 22.11 C ATOM 1036 CG2 VAL A 99 -6.385 16.012 -11.312 1.00 31.34 C ATOM 0 H VAL A 99 -3.507 16.455 -9.560 1.00 71.04 H new ATOM 0 HA VAL A 99 -6.040 15.429 -8.534 1.00 2.10 H new ATOM 0 HB VAL A 99 -4.922 14.468 -11.191 1.00 72.33 H new ATOM 0 HG11 VAL A 99 -7.130 13.402 -11.402 1.00 22.11 H new ATOM 0 HG12 VAL A 99 -6.265 12.848 -9.948 1.00 22.11 H new ATOM 0 HG13 VAL A 99 -7.584 14.034 -9.801 1.00 22.11 H new ATOM 0 HG21 VAL A 99 -6.767 15.683 -12.278 1.00 31.34 H new ATOM 0 HG22 VAL A 99 -7.205 16.410 -10.714 1.00 31.34 H new ATOM 0 HG23 VAL A 99 -5.636 16.790 -11.464 1.00 31.34 H new ATOM 1046 N PRO A 100 -4.835 13.387 -7.723 1.00 64.42 N ATOM 1047 CA PRO A 100 -4.093 12.287 -7.098 1.00 13.42 C ATOM 1048 C PRO A 100 -3.846 11.132 -8.062 1.00 52.42 C ATOM 1049 O PRO A 100 -4.765 10.667 -8.737 1.00 20.34 O ATOM 1050 CB PRO A 100 -5.012 11.844 -5.957 1.00 10.04 C ATOM 1051 CG PRO A 100 -6.379 12.246 -6.392 1.00 43.24 C ATOM 1052 CD PRO A 100 -6.204 13.506 -7.194 1.00 4.41 C ATOM 0 HA PRO A 100 -3.102 12.599 -6.769 1.00 13.42 H new ATOM 0 HB2 PRO A 100 -4.949 10.768 -5.793 1.00 10.04 H new ATOM 0 HB3 PRO A 100 -4.738 12.326 -5.018 1.00 10.04 H new ATOM 0 HG2 PRO A 100 -6.844 11.463 -6.991 1.00 43.24 H new ATOM 0 HG3 PRO A 100 -7.028 12.417 -5.533 1.00 43.24 H new ATOM 0 HD2 PRO A 100 -6.939 13.578 -7.995 1.00 4.41 H new ATOM 0 HD3 PRO A 100 -6.320 14.396 -6.575 1.00 4.41 H new ATOM 1060 N TYR A 101 -2.601 10.674 -8.122 1.00 42.33 N ATOM 1061 CA TYR A 101 -2.233 9.574 -9.006 1.00 2.41 C ATOM 1062 C TYR A 101 -1.785 8.357 -8.203 1.00 72.20 C ATOM 1063 O TYR A 101 -1.762 8.386 -6.972 1.00 71.42 O ATOM 1064 CB TYR A 101 -1.118 10.009 -9.959 1.00 2.14 C ATOM 1065 CG TYR A 101 -0.586 11.396 -9.676 1.00 20.14 C ATOM 1066 CD1 TYR A 101 0.317 11.617 -8.643 1.00 11.51 C ATOM 1067 CD2 TYR A 101 -0.987 12.485 -10.440 1.00 21.41 C ATOM 1068 CE1 TYR A 101 0.805 12.883 -8.380 1.00 60.11 C ATOM 1069 CE2 TYR A 101 -0.503 13.753 -10.185 1.00 42.13 C ATOM 1070 CZ TYR A 101 0.393 13.947 -9.154 1.00 54.23 C ATOM 1071 OH TYR A 101 0.876 15.210 -8.897 1.00 30.44 O ATOM 0 H TYR A 101 -1.829 11.047 -7.569 1.00 42.33 H new ATOM 0 HA TYR A 101 -3.113 9.299 -9.588 1.00 2.41 H new ATOM 0 HB2 TYR A 101 -0.298 9.294 -9.895 1.00 2.14 H new ATOM 0 HB3 TYR A 101 -1.492 9.974 -10.982 1.00 2.14 H new ATOM 0 HD1 TYR A 101 0.643 10.786 -8.036 1.00 11.51 H new ATOM 0 HD2 TYR A 101 -1.689 12.337 -11.247 1.00 21.41 H new ATOM 0 HE1 TYR A 101 1.505 13.038 -7.573 1.00 60.11 H new ATOM 0 HE2 TYR A 101 -0.824 14.588 -10.789 1.00 42.13 H new ATOM 0 HH TYR A 101 0.397 15.594 -8.133 1.00 30.44 H new ATOM 1081 N ILE A 102 -1.430 7.289 -8.909 1.00 61.21 N ATOM 1082 CA ILE A 102 -0.981 6.062 -8.263 1.00 71.55 C ATOM 1083 C ILE A 102 0.156 5.413 -9.045 1.00 43.33 C ATOM 1084 O ILE A 102 0.129 5.362 -10.275 1.00 55.12 O ATOM 1085 CB ILE A 102 -2.132 5.048 -8.118 1.00 50.44 C ATOM 1086 CG1 ILE A 102 -3.305 5.680 -7.367 1.00 12.54 C ATOM 1087 CG2 ILE A 102 -1.649 3.797 -7.401 1.00 23.11 C ATOM 1088 CD1 ILE A 102 -4.222 6.495 -8.252 1.00 60.13 C ATOM 0 H ILE A 102 -1.445 7.249 -9.928 1.00 61.21 H new ATOM 0 HA ILE A 102 -0.625 6.340 -7.271 1.00 71.55 H new ATOM 0 HB ILE A 102 -2.473 4.763 -9.113 1.00 50.44 H new ATOM 0 HG12 ILE A 102 -3.884 4.892 -6.886 1.00 12.54 H new ATOM 0 HG13 ILE A 102 -2.916 6.319 -6.574 1.00 12.54 H new ATOM 0 HG21 ILE A 102 -2.474 3.091 -7.306 1.00 23.11 H new ATOM 0 HG22 ILE A 102 -0.842 3.339 -7.973 1.00 23.11 H new ATOM 0 HG23 ILE A 102 -1.284 4.064 -6.409 1.00 23.11 H new ATOM 0 HD11 ILE A 102 -5.030 6.913 -7.652 1.00 60.13 H new ATOM 0 HD12 ILE A 102 -3.657 7.305 -8.713 1.00 60.13 H new ATOM 0 HD13 ILE A 102 -4.640 5.856 -9.029 1.00 60.13 H new ATOM 1100 N PHE A 103 1.156 4.917 -8.323 1.00 53.24 N ATOM 1101 CA PHE A 103 2.303 4.271 -8.949 1.00 63.41 C ATOM 1102 C PHE A 103 2.062 2.773 -9.112 1.00 74.12 C ATOM 1103 O PHE A 103 1.841 2.059 -8.133 1.00 61.15 O ATOM 1104 CB PHE A 103 3.565 4.507 -8.117 1.00 43.40 C ATOM 1105 CG PHE A 103 4.737 4.982 -8.928 1.00 25.25 C ATOM 1106 CD1 PHE A 103 5.127 4.302 -10.070 1.00 63.11 C ATOM 1107 CD2 PHE A 103 5.450 6.107 -8.546 1.00 50.44 C ATOM 1108 CE1 PHE A 103 6.205 4.736 -10.818 1.00 63.05 C ATOM 1109 CE2 PHE A 103 6.528 6.546 -9.291 1.00 4.41 C ATOM 1110 CZ PHE A 103 6.907 5.859 -10.428 1.00 3.24 C ATOM 0 H PHE A 103 1.195 4.950 -7.304 1.00 53.24 H new ATOM 0 HA PHE A 103 2.440 4.709 -9.938 1.00 63.41 H new ATOM 0 HB2 PHE A 103 3.348 5.242 -7.342 1.00 43.40 H new ATOM 0 HB3 PHE A 103 3.835 3.580 -7.611 1.00 43.40 H new ATOM 0 HD1 PHE A 103 4.582 3.422 -10.380 1.00 63.11 H new ATOM 0 HD2 PHE A 103 5.160 6.647 -7.656 1.00 50.44 H new ATOM 0 HE1 PHE A 103 6.498 4.197 -11.707 1.00 63.05 H new ATOM 0 HE2 PHE A 103 7.074 7.426 -8.984 1.00 4.41 H new ATOM 0 HZ PHE A 103 7.750 6.200 -11.010 1.00 3.24 H new ATOM 1120 N ILE A 104 2.104 2.305 -10.355 1.00 23.30 N ATOM 1121 CA ILE A 104 1.891 0.893 -10.647 1.00 33.34 C ATOM 1122 C ILE A 104 2.513 0.507 -11.985 1.00 15.44 C ATOM 1123 O ILE A 104 2.894 1.359 -12.788 1.00 75.33 O ATOM 1124 CB ILE A 104 0.391 0.543 -10.671 1.00 11.42 C ATOM 1125 CG1 ILE A 104 -0.439 1.787 -10.997 1.00 73.55 C ATOM 1126 CG2 ILE A 104 -0.036 -0.050 -9.337 1.00 14.13 C ATOM 1127 CD1 ILE A 104 -1.916 1.502 -11.157 1.00 34.02 C ATOM 0 H ILE A 104 2.284 2.883 -11.176 1.00 23.30 H new ATOM 0 HA ILE A 104 2.375 0.330 -9.849 1.00 33.34 H new ATOM 0 HB ILE A 104 0.219 -0.201 -11.449 1.00 11.42 H new ATOM 0 HG12 ILE A 104 -0.303 2.523 -10.204 1.00 73.55 H new ATOM 0 HG13 ILE A 104 -0.062 2.235 -11.916 1.00 73.55 H new ATOM 0 HG21 ILE A 104 -1.098 -0.292 -9.370 1.00 14.13 H new ATOM 0 HG22 ILE A 104 0.537 -0.957 -9.142 1.00 14.13 H new ATOM 0 HG23 ILE A 104 0.147 0.673 -8.542 1.00 14.13 H new ATOM 0 HD11 ILE A 104 -2.442 2.428 -11.387 1.00 34.02 H new ATOM 0 HD12 ILE A 104 -2.063 0.790 -11.969 1.00 34.02 H new ATOM 0 HD13 ILE A 104 -2.308 1.082 -10.231 1.00 34.02 H new ATOM 1139 N PRO A 105 2.617 -0.807 -12.232 1.00 51.30 N ATOM 1140 CA PRO A 105 3.190 -1.335 -13.474 1.00 33.45 C ATOM 1141 C PRO A 105 2.294 -1.080 -14.680 1.00 55.34 C ATOM 1142 O PRO A 105 1.405 -0.229 -14.637 1.00 11.04 O ATOM 1143 CB PRO A 105 3.303 -2.837 -13.200 1.00 63.34 C ATOM 1144 CG PRO A 105 2.263 -3.115 -12.170 1.00 43.44 C ATOM 1145 CD PRO A 105 2.183 -1.878 -11.319 1.00 42.31 C ATOM 0 HA PRO A 105 4.139 -0.859 -13.720 1.00 33.45 H new ATOM 0 HB2 PRO A 105 3.129 -3.419 -14.105 1.00 63.34 H new ATOM 0 HB3 PRO A 105 4.297 -3.100 -12.839 1.00 63.34 H new ATOM 0 HG2 PRO A 105 1.301 -3.332 -12.635 1.00 43.44 H new ATOM 0 HG3 PRO A 105 2.530 -3.985 -11.570 1.00 43.44 H new ATOM 0 HD2 PRO A 105 1.171 -1.708 -10.952 1.00 42.31 H new ATOM 0 HD3 PRO A 105 2.831 -1.949 -10.445 1.00 42.31 H new ATOM 1153 N SER A 106 2.532 -1.822 -15.757 1.00 4.20 N ATOM 1154 CA SER A 106 1.749 -1.673 -16.977 1.00 55.25 C ATOM 1155 C SER A 106 1.244 -3.027 -17.468 1.00 45.41 C ATOM 1156 O SER A 106 0.064 -3.188 -17.779 1.00 0.22 O ATOM 1157 CB SER A 106 2.586 -1.002 -18.068 1.00 0.10 C ATOM 1158 OG SER A 106 3.299 -1.963 -18.827 1.00 3.12 O ATOM 0 H SER A 106 3.262 -2.533 -15.809 1.00 4.20 H new ATOM 0 HA SER A 106 0.888 -1.044 -16.751 1.00 55.25 H new ATOM 0 HB2 SER A 106 1.936 -0.424 -18.725 1.00 0.10 H new ATOM 0 HB3 SER A 106 3.286 -0.300 -17.614 1.00 0.10 H new ATOM 0 HG SER A 106 3.825 -1.509 -19.519 1.00 3.12 H new ATOM 1164 N LYS A 107 2.148 -3.998 -17.535 1.00 62.34 N ATOM 1165 CA LYS A 107 1.798 -5.340 -17.987 1.00 10.23 C ATOM 1166 C LYS A 107 0.539 -5.839 -17.284 1.00 42.34 C ATOM 1167 O LYS A 107 -0.509 -5.997 -17.910 1.00 21.25 O ATOM 1168 CB LYS A 107 2.956 -6.306 -17.728 1.00 2.13 C ATOM 1169 CG LYS A 107 4.237 -5.928 -18.452 1.00 32.30 C ATOM 1170 CD LYS A 107 4.963 -7.155 -18.977 1.00 23.45 C ATOM 1171 CE LYS A 107 4.477 -7.540 -20.366 1.00 3.53 C ATOM 1172 NZ LYS A 107 5.545 -8.204 -21.163 1.00 44.40 N ATOM 0 H LYS A 107 3.129 -3.881 -17.282 1.00 62.34 H new ATOM 0 HA LYS A 107 1.602 -5.296 -19.058 1.00 10.23 H new ATOM 0 HB2 LYS A 107 3.152 -6.346 -16.657 1.00 2.13 H new ATOM 0 HB3 LYS A 107 2.657 -7.308 -18.035 1.00 2.13 H new ATOM 0 HG2 LYS A 107 4.004 -5.260 -19.281 1.00 32.30 H new ATOM 0 HG3 LYS A 107 4.891 -5.379 -17.774 1.00 32.30 H new ATOM 0 HD2 LYS A 107 6.035 -6.959 -19.007 1.00 23.45 H new ATOM 0 HD3 LYS A 107 4.810 -7.990 -18.293 1.00 23.45 H new ATOM 0 HE2 LYS A 107 3.620 -8.208 -20.279 1.00 3.53 H new ATOM 0 HE3 LYS A 107 4.134 -6.648 -20.891 1.00 3.53 H new ATOM 0 HZ1 LYS A 107 5.174 -8.451 -22.103 1.00 44.40 H new ATOM 0 HZ2 LYS A 107 6.353 -7.557 -21.268 1.00 44.40 H new ATOM 0 HZ3 LYS A 107 5.855 -9.069 -20.675 1.00 44.40 H new ATOM 1186 N GLN A 108 0.651 -6.083 -15.983 1.00 15.44 N ATOM 1187 CA GLN A 108 -0.480 -6.563 -15.196 1.00 42.45 C ATOM 1188 C GLN A 108 -1.438 -5.422 -14.869 1.00 32.54 C ATOM 1189 O GLN A 108 -2.651 -5.551 -15.036 1.00 11.43 O ATOM 1190 CB GLN A 108 0.012 -7.219 -13.905 1.00 50.31 C ATOM 1191 CG GLN A 108 -0.915 -8.305 -13.383 1.00 43.14 C ATOM 1192 CD GLN A 108 -0.313 -9.080 -12.228 1.00 21.11 C ATOM 1193 OE1 GLN A 108 -0.374 -8.648 -11.077 1.00 12.15 O ATOM 1194 NE2 GLN A 108 0.273 -10.233 -12.529 1.00 42.24 N ATOM 0 H GLN A 108 1.512 -5.957 -15.451 1.00 15.44 H new ATOM 0 HA GLN A 108 -1.016 -7.304 -15.789 1.00 42.45 H new ATOM 0 HB2 GLN A 108 0.999 -7.648 -14.078 1.00 50.31 H new ATOM 0 HB3 GLN A 108 0.128 -6.452 -13.139 1.00 50.31 H new ATOM 0 HG2 GLN A 108 -1.854 -7.853 -13.062 1.00 43.14 H new ATOM 0 HG3 GLN A 108 -1.153 -8.994 -14.193 1.00 43.14 H new ATOM 0 HE21 GLN A 108 0.301 -10.554 -13.497 1.00 42.24 H new ATOM 0 HE22 GLN A 108 0.695 -10.798 -11.792 1.00 42.24 H new ATOM 1203 N ASP A 109 -0.886 -4.308 -14.401 1.00 31.41 N ATOM 1204 CA ASP A 109 -1.692 -3.145 -14.050 1.00 1.31 C ATOM 1205 C ASP A 109 -2.676 -2.808 -15.166 1.00 65.13 C ATOM 1206 O ASP A 109 -3.890 -2.908 -14.989 1.00 14.20 O ATOM 1207 CB ASP A 109 -0.792 -1.941 -13.766 1.00 62.13 C ATOM 1208 CG ASP A 109 -1.573 -0.646 -13.663 1.00 44.32 C ATOM 1209 OD1 ASP A 109 -2.708 -0.677 -13.143 1.00 42.40 O ATOM 1210 OD2 ASP A 109 -1.048 0.399 -14.102 1.00 12.12 O ATOM 0 H ASP A 109 0.116 -4.186 -14.256 1.00 31.41 H new ATOM 0 HA ASP A 109 -2.259 -3.385 -13.151 1.00 1.31 H new ATOM 0 HB2 ASP A 109 -0.248 -2.109 -12.836 1.00 62.13 H new ATOM 0 HB3 ASP A 109 -0.049 -1.852 -14.558 1.00 62.13 H new ATOM 1215 N LEU A 110 -2.143 -2.408 -16.316 1.00 33.40 N ATOM 1216 CA LEU A 110 -2.974 -2.056 -17.462 1.00 52.30 C ATOM 1217 C LEU A 110 -3.579 -3.302 -18.100 1.00 71.02 C ATOM 1218 O LEU A 110 -4.779 -3.355 -18.368 1.00 43.21 O ATOM 1219 CB LEU A 110 -2.150 -1.288 -18.497 1.00 53.40 C ATOM 1220 CG LEU A 110 -1.424 -0.043 -17.987 1.00 3.33 C ATOM 1221 CD1 LEU A 110 -0.441 0.467 -19.030 1.00 21.35 C ATOM 1222 CD2 LEU A 110 -2.423 1.044 -17.617 1.00 23.01 C ATOM 0 H LEU A 110 -1.140 -2.320 -16.479 1.00 33.40 H new ATOM 0 HA LEU A 110 -3.786 -1.421 -17.109 1.00 52.30 H new ATOM 0 HB2 LEU A 110 -1.410 -1.968 -18.920 1.00 53.40 H new ATOM 0 HB3 LEU A 110 -2.812 -0.991 -19.311 1.00 53.40 H new ATOM 0 HG LEU A 110 -0.864 -0.314 -17.092 1.00 3.33 H new ATOM 0 HD11 LEU A 110 0.066 1.353 -18.649 1.00 21.35 H new ATOM 0 HD12 LEU A 110 0.295 -0.308 -19.246 1.00 21.35 H new ATOM 0 HD13 LEU A 110 -0.979 0.721 -19.943 1.00 21.35 H new ATOM 0 HD21 LEU A 110 -1.888 1.922 -17.256 1.00 23.01 H new ATOM 0 HD22 LEU A 110 -3.011 1.312 -18.495 1.00 23.01 H new ATOM 0 HD23 LEU A 110 -3.087 0.677 -16.834 1.00 23.01 H new ATOM 1234 N GLY A 111 -2.740 -4.305 -18.339 1.00 62.23 N ATOM 1235 CA GLY A 111 -3.210 -5.539 -18.942 1.00 55.40 C ATOM 1236 C GLY A 111 -4.480 -6.053 -18.294 1.00 34.04 C ATOM 1237 O GLY A 111 -5.462 -6.340 -18.978 1.00 14.44 O ATOM 0 H GLY A 111 -1.743 -4.285 -18.126 1.00 62.23 H new ATOM 0 HA2 GLY A 111 -3.388 -5.376 -20.005 1.00 55.40 H new ATOM 0 HA3 GLY A 111 -2.432 -6.298 -18.862 1.00 55.40 H new ATOM 1241 N ALA A 112 -4.461 -6.172 -16.970 1.00 42.00 N ATOM 1242 CA ALA A 112 -5.619 -6.655 -16.229 1.00 74.23 C ATOM 1243 C ALA A 112 -6.722 -5.602 -16.186 1.00 64.32 C ATOM 1244 O ALA A 112 -7.889 -5.902 -16.432 1.00 74.24 O ATOM 1245 CB ALA A 112 -5.214 -7.056 -14.818 1.00 52.15 C ATOM 0 H ALA A 112 -3.655 -5.940 -16.389 1.00 42.00 H new ATOM 0 HA ALA A 112 -6.010 -7.532 -16.746 1.00 74.23 H new ATOM 0 HB1 ALA A 112 -6.089 -7.415 -14.276 1.00 52.15 H new ATOM 0 HB2 ALA A 112 -4.467 -7.848 -14.865 1.00 52.15 H new ATOM 0 HB3 ALA A 112 -4.796 -6.193 -14.300 1.00 52.15 H new ATOM 1251 N ALA A 113 -6.343 -4.368 -15.871 1.00 65.11 N ATOM 1252 CA ALA A 113 -7.299 -3.271 -15.797 1.00 40.42 C ATOM 1253 C ALA A 113 -8.054 -3.111 -17.112 1.00 41.24 C ATOM 1254 O ALA A 113 -9.136 -2.527 -17.151 1.00 73.32 O ATOM 1255 CB ALA A 113 -6.589 -1.975 -15.433 1.00 62.22 C ATOM 0 H ALA A 113 -5.380 -4.103 -15.663 1.00 65.11 H new ATOM 0 HA ALA A 113 -8.024 -3.506 -15.018 1.00 40.42 H new ATOM 0 HB1 ALA A 113 -7.316 -1.164 -15.381 1.00 62.22 H new ATOM 0 HB2 ALA A 113 -6.101 -2.087 -14.465 1.00 62.22 H new ATOM 0 HB3 ALA A 113 -5.841 -1.744 -16.192 1.00 62.22 H new ATOM 1261 N GLY A 114 -7.475 -3.633 -18.189 1.00 43.14 N ATOM 1262 CA GLY A 114 -8.107 -3.536 -19.492 1.00 61.41 C ATOM 1263 C GLY A 114 -7.125 -3.169 -20.587 1.00 55.31 C ATOM 1264 O GLY A 114 -7.328 -2.194 -21.310 1.00 55.21 O ATOM 0 H GLY A 114 -6.580 -4.121 -18.182 1.00 43.14 H new ATOM 0 HA2 GLY A 114 -8.579 -4.488 -19.735 1.00 61.41 H new ATOM 0 HA3 GLY A 114 -8.899 -2.788 -19.453 1.00 61.41 H new ATOM 1268 N ALA A 115 -6.057 -3.950 -20.709 1.00 73.00 N ATOM 1269 CA ALA A 115 -5.041 -3.701 -21.724 1.00 21.52 C ATOM 1270 C ALA A 115 -4.514 -5.009 -22.305 1.00 72.21 C ATOM 1271 O ALA A 115 -3.309 -5.265 -22.296 1.00 15.22 O ATOM 1272 CB ALA A 115 -3.899 -2.884 -21.138 1.00 70.20 C ATOM 0 H ALA A 115 -5.873 -4.760 -20.118 1.00 73.00 H new ATOM 0 HA ALA A 115 -5.502 -3.134 -22.533 1.00 21.52 H new ATOM 0 HB1 ALA A 115 -3.147 -2.705 -21.907 1.00 70.20 H new ATOM 0 HB2 ALA A 115 -4.282 -1.930 -20.777 1.00 70.20 H new ATOM 0 HB3 ALA A 115 -3.448 -3.431 -20.310 1.00 70.20 H new ATOM 1278 N THR A 116 -5.424 -5.836 -22.811 1.00 14.05 N ATOM 1279 CA THR A 116 -5.052 -7.118 -23.394 1.00 63.33 C ATOM 1280 C THR A 116 -4.267 -6.927 -24.687 1.00 53.32 C ATOM 1281 O THR A 116 -4.837 -6.602 -25.729 1.00 71.23 O ATOM 1282 CB THR A 116 -6.292 -7.986 -23.683 1.00 45.41 C ATOM 1283 OG1 THR A 116 -7.224 -7.254 -24.486 1.00 75.45 O ATOM 1284 CG2 THR A 116 -6.961 -8.421 -22.388 1.00 52.44 C ATOM 0 H THR A 116 -6.425 -5.640 -22.828 1.00 14.05 H new ATOM 0 HA THR A 116 -4.424 -7.627 -22.663 1.00 63.33 H new ATOM 0 HB THR A 116 -5.969 -8.876 -24.223 1.00 45.41 H new ATOM 0 HG1 THR A 116 -6.745 -6.799 -25.210 1.00 75.45 H new ATOM 0 HG21 THR A 116 -7.834 -9.033 -22.617 1.00 52.44 H new ATOM 0 HG22 THR A 116 -6.257 -9.002 -21.792 1.00 52.44 H new ATOM 0 HG23 THR A 116 -7.272 -7.541 -21.826 1.00 52.44 H new ATOM 1292 N LYS A 117 -2.956 -7.130 -24.614 1.00 12.21 N ATOM 1293 CA LYS A 117 -2.092 -6.982 -25.779 1.00 52.50 C ATOM 1294 C LYS A 117 -2.078 -5.536 -26.265 1.00 51.14 C ATOM 1295 O LYS A 117 -2.200 -5.273 -27.462 1.00 12.42 O ATOM 1296 CB LYS A 117 -2.558 -7.906 -26.906 1.00 55.43 C ATOM 1297 CG LYS A 117 -1.515 -8.118 -27.990 1.00 13.43 C ATOM 1298 CD LYS A 117 -2.159 -8.426 -29.331 1.00 71.10 C ATOM 1299 CE LYS A 117 -2.223 -9.924 -29.587 1.00 60.02 C ATOM 1300 NZ LYS A 117 -0.925 -10.457 -30.086 1.00 30.33 N ATOM 0 H LYS A 117 -2.468 -7.398 -23.759 1.00 12.21 H new ATOM 0 HA LYS A 117 -1.079 -7.259 -25.487 1.00 52.50 H new ATOM 0 HB2 LYS A 117 -2.831 -8.872 -26.482 1.00 55.43 H new ATOM 0 HB3 LYS A 117 -3.459 -7.490 -27.357 1.00 55.43 H new ATOM 0 HG2 LYS A 117 -0.895 -7.226 -28.079 1.00 13.43 H new ATOM 0 HG3 LYS A 117 -0.855 -8.937 -27.706 1.00 13.43 H new ATOM 0 HD2 LYS A 117 -3.165 -8.008 -29.357 1.00 71.10 H new ATOM 0 HD3 LYS A 117 -1.592 -7.943 -30.127 1.00 71.10 H new ATOM 0 HE2 LYS A 117 -2.497 -10.439 -28.666 1.00 60.02 H new ATOM 0 HE3 LYS A 117 -3.006 -10.135 -30.315 1.00 60.02 H new ATOM 0 HZ1 LYS A 117 -1.010 -11.481 -30.248 1.00 30.33 H new ATOM 0 HZ2 LYS A 117 -0.676 -9.984 -30.978 1.00 30.33 H new ATOM 0 HZ3 LYS A 117 -0.182 -10.279 -29.380 1.00 30.33 H new ATOM 1314 N ARG A 118 -1.927 -4.603 -25.331 1.00 20.32 N ATOM 1315 CA ARG A 118 -1.897 -3.185 -25.665 1.00 45.50 C ATOM 1316 C ARG A 118 -1.566 -2.343 -24.436 1.00 33.35 C ATOM 1317 O ARG A 118 -2.418 -1.649 -23.881 1.00 35.01 O ATOM 1318 CB ARG A 118 -3.241 -2.747 -26.249 1.00 71.41 C ATOM 1319 CG ARG A 118 -3.267 -1.296 -26.698 1.00 50.50 C ATOM 1320 CD ARG A 118 -2.902 -1.160 -28.168 1.00 24.31 C ATOM 1321 NE ARG A 118 -1.488 -1.439 -28.409 1.00 34.45 N ATOM 1322 CZ ARG A 118 -0.506 -0.621 -28.048 1.00 60.04 C ATOM 1323 NH1 ARG A 118 -0.782 0.521 -27.434 1.00 42.23 N ATOM 1324 NH2 ARG A 118 0.756 -0.945 -28.302 1.00 15.10 N ATOM 0 H ARG A 118 -1.823 -4.804 -24.336 1.00 20.32 H new ATOM 0 HA ARG A 118 -1.117 -3.031 -26.411 1.00 45.50 H new ATOM 0 HB2 ARG A 118 -3.484 -3.386 -27.098 1.00 71.41 H new ATOM 0 HB3 ARG A 118 -4.020 -2.901 -25.502 1.00 71.41 H new ATOM 0 HG2 ARG A 118 -4.260 -0.880 -26.529 1.00 50.50 H new ATOM 0 HG3 ARG A 118 -2.570 -0.715 -26.094 1.00 50.50 H new ATOM 0 HD2 ARG A 118 -3.512 -1.844 -28.758 1.00 24.31 H new ATOM 0 HD3 ARG A 118 -3.135 -0.151 -28.508 1.00 24.31 H new ATOM 0 HE ARG A 118 -1.242 -2.309 -28.880 1.00 34.45 H new ATOM 0 HH11 ARG A 118 -1.751 0.773 -27.238 1.00 42.23 H new ATOM 0 HH12 ARG A 118 -0.026 1.147 -27.158 1.00 42.23 H new ATOM 0 HH21 ARG A 118 0.972 -1.823 -28.775 1.00 15.10 H new ATOM 0 HH22 ARG A 118 1.510 -0.316 -28.024 1.00 15.10 H new ATOM 1338 N PRO A 119 -0.300 -2.406 -23.998 1.00 41.01 N ATOM 1339 CA PRO A 119 0.172 -1.657 -22.830 1.00 0.41 C ATOM 1340 C PRO A 119 0.233 -0.155 -23.090 1.00 71.31 C ATOM 1341 O PRO A 119 0.866 0.295 -24.046 1.00 15.10 O ATOM 1342 CB PRO A 119 1.577 -2.216 -22.594 1.00 3.31 C ATOM 1343 CG PRO A 119 2.014 -2.719 -23.926 1.00 54.25 C ATOM 1344 CD PRO A 119 0.769 -3.213 -24.610 1.00 51.24 C ATOM 0 HA PRO A 119 -0.496 -1.771 -21.976 1.00 0.41 H new ATOM 0 HB2 PRO A 119 2.252 -1.446 -22.221 1.00 3.31 H new ATOM 0 HB3 PRO A 119 1.566 -3.016 -21.853 1.00 3.31 H new ATOM 0 HG2 PRO A 119 2.490 -1.928 -24.505 1.00 54.25 H new ATOM 0 HG3 PRO A 119 2.745 -3.520 -23.820 1.00 54.25 H new ATOM 0 HD2 PRO A 119 0.817 -3.064 -25.689 1.00 51.24 H new ATOM 0 HD3 PRO A 119 0.614 -4.279 -24.442 1.00 51.24 H new ATOM 1352 N THR A 120 -0.429 0.617 -22.233 1.00 63.43 N ATOM 1353 CA THR A 120 -0.450 2.067 -22.371 1.00 53.30 C ATOM 1354 C THR A 120 0.550 2.724 -21.427 1.00 11.23 C ATOM 1355 O THR A 120 1.266 2.042 -20.693 1.00 55.40 O ATOM 1356 CB THR A 120 -1.854 2.637 -22.091 1.00 42.34 C ATOM 1357 OG1 THR A 120 -2.823 1.583 -22.106 1.00 25.11 O ATOM 1358 CG2 THR A 120 -2.226 3.689 -23.125 1.00 53.41 C ATOM 0 H THR A 120 -0.957 0.261 -21.436 1.00 63.43 H new ATOM 0 HA THR A 120 -0.173 2.291 -23.401 1.00 53.30 H new ATOM 0 HB THR A 120 -1.843 3.105 -21.107 1.00 42.34 H new ATOM 0 HG1 THR A 120 -3.375 1.634 -21.298 1.00 25.11 H new ATOM 0 HG21 THR A 120 -3.221 4.077 -22.907 1.00 53.41 H new ATOM 0 HG22 THR A 120 -1.503 4.504 -23.091 1.00 53.41 H new ATOM 0 HG23 THR A 120 -2.221 3.241 -24.118 1.00 53.41 H new ATOM 1366 N SER A 121 0.594 4.052 -21.450 1.00 1.54 N ATOM 1367 CA SER A 121 1.510 4.802 -20.597 1.00 34.40 C ATOM 1368 C SER A 121 0.742 5.635 -19.576 1.00 14.05 C ATOM 1369 O SER A 121 0.671 5.284 -18.398 1.00 2.14 O ATOM 1370 CB SER A 121 2.402 5.710 -21.445 1.00 63.51 C ATOM 1371 OG SER A 121 1.844 5.917 -22.731 1.00 30.21 O ATOM 0 H SER A 121 0.006 4.631 -22.050 1.00 1.54 H new ATOM 0 HA SER A 121 2.135 4.088 -20.061 1.00 34.40 H new ATOM 0 HB2 SER A 121 2.532 6.669 -20.943 1.00 63.51 H new ATOM 0 HB3 SER A 121 3.392 5.264 -21.542 1.00 63.51 H new ATOM 0 HG SER A 121 2.432 6.502 -23.253 1.00 30.21 H new ATOM 1377 N VAL A 122 0.167 6.742 -20.036 1.00 32.40 N ATOM 1378 CA VAL A 122 -0.597 7.626 -19.164 1.00 74.22 C ATOM 1379 C VAL A 122 -2.079 7.268 -19.182 1.00 14.43 C ATOM 1380 O VAL A 122 -2.771 7.492 -20.175 1.00 73.21 O ATOM 1381 CB VAL A 122 -0.431 9.101 -19.576 1.00 34.32 C ATOM 1382 CG1 VAL A 122 0.931 9.624 -19.148 1.00 43.44 C ATOM 1383 CG2 VAL A 122 -0.626 9.260 -21.076 1.00 73.10 C ATOM 0 H VAL A 122 0.216 7.048 -21.008 1.00 32.40 H new ATOM 0 HA VAL A 122 -0.206 7.492 -18.155 1.00 74.22 H new ATOM 0 HB VAL A 122 -1.195 9.691 -19.070 1.00 34.32 H new ATOM 0 HG11 VAL A 122 1.031 10.667 -19.447 1.00 43.44 H new ATOM 0 HG12 VAL A 122 1.027 9.546 -18.065 1.00 43.44 H new ATOM 0 HG13 VAL A 122 1.714 9.034 -19.624 1.00 43.44 H new ATOM 0 HG21 VAL A 122 -0.505 10.308 -21.350 1.00 73.10 H new ATOM 0 HG22 VAL A 122 0.114 8.659 -21.605 1.00 73.10 H new ATOM 0 HG23 VAL A 122 -1.627 8.926 -21.350 1.00 73.10 H new ATOM 1393 N VAL A 123 -2.561 6.712 -18.075 1.00 15.01 N ATOM 1394 CA VAL A 123 -3.963 6.325 -17.962 1.00 25.33 C ATOM 1395 C VAL A 123 -4.584 6.879 -16.685 1.00 35.22 C ATOM 1396 O VAL A 123 -3.925 6.970 -15.649 1.00 40.01 O ATOM 1397 CB VAL A 123 -4.124 4.793 -17.976 1.00 13.13 C ATOM 1398 CG1 VAL A 123 -3.068 4.136 -17.100 1.00 42.35 C ATOM 1399 CG2 VAL A 123 -5.523 4.401 -17.523 1.00 4.34 C ATOM 0 H VAL A 123 -2.002 6.519 -17.244 1.00 15.01 H new ATOM 0 HA VAL A 123 -4.479 6.745 -18.825 1.00 25.33 H new ATOM 0 HB VAL A 123 -3.984 4.440 -18.998 1.00 13.13 H new ATOM 0 HG11 VAL A 123 -3.198 3.054 -17.123 1.00 42.35 H new ATOM 0 HG12 VAL A 123 -2.076 4.390 -17.473 1.00 42.35 H new ATOM 0 HG13 VAL A 123 -3.172 4.492 -16.075 1.00 42.35 H new ATOM 0 HG21 VAL A 123 -5.620 3.315 -17.539 1.00 4.34 H new ATOM 0 HG22 VAL A 123 -5.693 4.766 -16.510 1.00 4.34 H new ATOM 0 HG23 VAL A 123 -6.260 4.841 -18.195 1.00 4.34 H new ATOM 1409 N PHE A 124 -5.859 7.247 -16.765 1.00 43.45 N ATOM 1410 CA PHE A 124 -6.571 7.793 -15.616 1.00 42.51 C ATOM 1411 C PHE A 124 -7.996 7.251 -15.551 1.00 45.00 C ATOM 1412 O PHE A 124 -8.523 6.743 -16.541 1.00 12.20 O ATOM 1413 CB PHE A 124 -6.598 9.322 -15.685 1.00 24.21 C ATOM 1414 CG PHE A 124 -7.676 9.863 -16.579 1.00 70.35 C ATOM 1415 CD1 PHE A 124 -7.536 9.824 -17.957 1.00 45.14 C ATOM 1416 CD2 PHE A 124 -8.830 10.409 -16.043 1.00 14.44 C ATOM 1417 CE1 PHE A 124 -8.526 10.322 -18.783 1.00 30.13 C ATOM 1418 CE2 PHE A 124 -9.825 10.908 -16.863 1.00 43.40 C ATOM 1419 CZ PHE A 124 -9.673 10.864 -18.235 1.00 25.41 C ATOM 0 H PHE A 124 -6.420 7.177 -17.614 1.00 43.45 H new ATOM 0 HA PHE A 124 -6.042 7.486 -14.714 1.00 42.51 H new ATOM 0 HB2 PHE A 124 -6.737 9.721 -14.680 1.00 24.21 H new ATOM 0 HB3 PHE A 124 -5.631 9.679 -16.039 1.00 24.21 H new ATOM 0 HD1 PHE A 124 -6.643 9.399 -18.391 1.00 45.14 H new ATOM 0 HD2 PHE A 124 -8.954 10.446 -14.971 1.00 14.44 H new ATOM 0 HE1 PHE A 124 -8.403 10.288 -19.855 1.00 30.13 H new ATOM 0 HE2 PHE A 124 -10.720 11.332 -16.431 1.00 43.40 H new ATOM 0 HZ PHE A 124 -10.449 11.252 -18.878 1.00 25.41 H new ATOM 1429 N ILE A 125 -8.611 7.362 -14.379 1.00 15.00 N ATOM 1430 CA ILE A 125 -9.975 6.884 -14.185 1.00 25.44 C ATOM 1431 C ILE A 125 -10.967 8.041 -14.172 1.00 1.32 C ATOM 1432 O ILE A 125 -10.774 9.031 -13.465 1.00 34.53 O ATOM 1433 CB ILE A 125 -10.111 6.091 -12.871 1.00 61.33 C ATOM 1434 CG1 ILE A 125 -9.635 4.650 -13.068 1.00 43.00 C ATOM 1435 CG2 ILE A 125 -11.552 6.116 -12.384 1.00 51.24 C ATOM 1436 CD1 ILE A 125 -8.199 4.546 -13.532 1.00 42.43 C ATOM 0 H ILE A 125 -8.187 7.778 -13.550 1.00 15.00 H new ATOM 0 HA ILE A 125 -10.201 6.225 -15.023 1.00 25.44 H new ATOM 0 HB ILE A 125 -9.484 6.561 -12.114 1.00 61.33 H new ATOM 0 HG12 ILE A 125 -9.745 4.108 -12.129 1.00 43.00 H new ATOM 0 HG13 ILE A 125 -10.280 4.159 -13.797 1.00 43.00 H new ATOM 0 HG21 ILE A 125 -11.632 5.552 -11.455 1.00 51.24 H new ATOM 0 HG22 ILE A 125 -11.859 7.147 -12.210 1.00 51.24 H new ATOM 0 HG23 ILE A 125 -12.199 5.667 -13.138 1.00 51.24 H new ATOM 0 HD11 ILE A 125 -7.930 3.496 -13.651 1.00 42.43 H new ATOM 0 HD12 ILE A 125 -8.087 5.059 -14.487 1.00 42.43 H new ATOM 0 HD13 ILE A 125 -7.544 5.007 -12.793 1.00 42.43 H new ATOM 1448 N VAL A 126 -12.031 7.910 -14.958 1.00 1.32 N ATOM 1449 CA VAL A 126 -13.056 8.944 -15.035 1.00 72.02 C ATOM 1450 C VAL A 126 -14.423 8.392 -14.647 1.00 12.34 C ATOM 1451 O VAL A 126 -15.208 7.957 -15.490 1.00 45.51 O ATOM 1452 CB VAL A 126 -13.141 9.546 -16.451 1.00 30.54 C ATOM 1453 CG1 VAL A 126 -13.370 8.452 -17.483 1.00 14.12 C ATOM 1454 CG2 VAL A 126 -14.242 10.594 -16.518 1.00 65.45 C ATOM 0 H VAL A 126 -12.206 7.098 -15.550 1.00 1.32 H new ATOM 0 HA VAL A 126 -12.770 9.726 -14.332 1.00 72.02 H new ATOM 0 HB VAL A 126 -12.193 10.033 -16.678 1.00 30.54 H new ATOM 0 HG11 VAL A 126 -13.427 8.896 -18.477 1.00 14.12 H new ATOM 0 HG12 VAL A 126 -12.544 7.742 -17.450 1.00 14.12 H new ATOM 0 HG13 VAL A 126 -14.303 7.934 -17.263 1.00 14.12 H new ATOM 0 HG21 VAL A 126 -14.288 11.009 -17.525 1.00 65.45 H new ATOM 0 HG22 VAL A 126 -15.198 10.133 -16.271 1.00 65.45 H new ATOM 0 HG23 VAL A 126 -14.029 11.392 -15.806 1.00 65.45 H new ATOM 1464 N PRO A 127 -14.718 8.410 -13.338 1.00 70.42 N ATOM 1465 CA PRO A 127 -15.992 7.915 -12.807 1.00 41.42 C ATOM 1466 C PRO A 127 -17.165 8.815 -13.183 1.00 64.44 C ATOM 1467 O PRO A 127 -17.744 9.485 -12.330 1.00 40.20 O ATOM 1468 CB PRO A 127 -15.773 7.928 -11.292 1.00 73.42 C ATOM 1469 CG PRO A 127 -14.725 8.963 -11.069 1.00 35.31 C ATOM 1470 CD PRO A 127 -13.831 8.913 -12.276 1.00 43.45 C ATOM 0 HA PRO A 127 -16.247 6.933 -13.207 1.00 41.42 H new ATOM 0 HB2 PRO A 127 -16.692 8.175 -10.761 1.00 73.42 H new ATOM 0 HB3 PRO A 127 -15.449 6.952 -10.931 1.00 73.42 H new ATOM 0 HG2 PRO A 127 -15.171 9.951 -10.954 1.00 35.31 H new ATOM 0 HG3 PRO A 127 -14.163 8.759 -10.158 1.00 35.31 H new ATOM 0 HD2 PRO A 127 -13.430 9.897 -12.520 1.00 43.45 H new ATOM 0 HD3 PRO A 127 -12.979 8.252 -12.118 1.00 43.45 H new ATOM 1478 N GLY A 128 -17.510 8.823 -14.467 1.00 41.34 N ATOM 1479 CA GLY A 128 -18.612 9.644 -14.934 1.00 35.35 C ATOM 1480 C GLY A 128 -18.255 11.115 -14.994 1.00 43.44 C ATOM 1481 O GLY A 128 -18.177 11.698 -16.076 1.00 12.11 O ATOM 0 H GLY A 128 -17.046 8.276 -15.192 1.00 41.34 H new ATOM 0 HA2 GLY A 128 -18.918 9.307 -15.925 1.00 35.35 H new ATOM 0 HA3 GLY A 128 -19.468 9.508 -14.273 1.00 35.35 H new ATOM 1485 N SER A 129 -18.038 11.719 -13.830 1.00 62.21 N ATOM 1486 CA SER A 129 -17.692 13.133 -13.755 1.00 2.40 C ATOM 1487 C SER A 129 -17.182 13.495 -12.363 1.00 64.43 C ATOM 1488 O SER A 129 -16.957 12.621 -11.527 1.00 12.24 O ATOM 1489 CB SER A 129 -18.906 13.996 -14.105 1.00 44.25 C ATOM 1490 OG SER A 129 -18.523 15.339 -14.350 1.00 34.24 O ATOM 0 H SER A 129 -18.096 11.251 -12.926 1.00 62.21 H new ATOM 0 HA SER A 129 -16.897 13.326 -14.476 1.00 2.40 H new ATOM 0 HB2 SER A 129 -19.403 13.590 -14.986 1.00 44.25 H new ATOM 0 HB3 SER A 129 -19.627 13.963 -13.288 1.00 44.25 H new ATOM 0 HG SER A 129 -18.567 15.521 -15.312 1.00 34.24 H new ATOM 1496 N ASN A 130 -17.001 14.789 -12.124 1.00 5.40 N ATOM 1497 CA ASN A 130 -16.516 15.268 -10.834 1.00 71.13 C ATOM 1498 C ASN A 130 -17.480 14.885 -9.715 1.00 63.11 C ATOM 1499 O ASN A 130 -17.072 14.340 -8.689 1.00 12.00 O ATOM 1500 CB ASN A 130 -16.332 16.786 -10.867 1.00 11.54 C ATOM 1501 CG ASN A 130 -15.215 17.253 -9.953 1.00 13.10 C ATOM 1502 OD1 ASN A 130 -14.057 17.337 -10.363 1.00 33.25 O ATOM 1503 ND2 ASN A 130 -15.559 17.559 -8.707 1.00 51.54 N ATOM 0 H ASN A 130 -17.183 15.525 -12.806 1.00 5.40 H new ATOM 0 HA ASN A 130 -15.553 14.797 -10.637 1.00 71.13 H new ATOM 0 HB2 ASN A 130 -16.118 17.101 -11.888 1.00 11.54 H new ATOM 0 HB3 ASN A 130 -17.264 17.269 -10.573 1.00 11.54 H new ATOM 0 HD21 ASN A 130 -14.851 17.879 -8.046 1.00 51.54 H new ATOM 0 HD22 ASN A 130 -16.531 17.474 -8.411 1.00 51.54 H new ATOM 1510 N LYS A 131 -18.760 15.173 -9.920 1.00 54.12 N ATOM 1511 CA LYS A 131 -19.784 14.858 -8.931 1.00 30.12 C ATOM 1512 C LYS A 131 -20.265 13.419 -9.085 1.00 74.24 C ATOM 1513 O LYS A 131 -20.656 12.776 -8.111 1.00 21.41 O ATOM 1514 CB LYS A 131 -20.967 15.820 -9.066 1.00 64.21 C ATOM 1515 CG LYS A 131 -21.813 15.573 -10.303 1.00 44.52 C ATOM 1516 CD LYS A 131 -22.363 16.871 -10.870 1.00 42.51 C ATOM 1517 CE LYS A 131 -23.662 17.271 -10.187 1.00 42.44 C ATOM 1518 NZ LYS A 131 -23.417 18.023 -8.926 1.00 4.34 N ATOM 0 H LYS A 131 -19.114 15.625 -10.763 1.00 54.12 H new ATOM 0 HA LYS A 131 -19.343 14.971 -7.940 1.00 30.12 H new ATOM 0 HB2 LYS A 131 -21.598 15.733 -8.181 1.00 64.21 H new ATOM 0 HB3 LYS A 131 -20.592 16.843 -9.091 1.00 64.21 H new ATOM 0 HG2 LYS A 131 -21.213 15.069 -11.061 1.00 44.52 H new ATOM 0 HG3 LYS A 131 -22.638 14.905 -10.054 1.00 44.52 H new ATOM 0 HD2 LYS A 131 -21.626 17.665 -10.746 1.00 42.51 H new ATOM 0 HD3 LYS A 131 -22.533 16.758 -11.941 1.00 42.51 H new ATOM 0 HE2 LYS A 131 -24.255 17.884 -10.866 1.00 42.44 H new ATOM 0 HE3 LYS A 131 -24.248 16.378 -9.969 1.00 42.44 H new ATOM 0 HZ1 LYS A 131 -23.869 17.526 -8.132 1.00 4.34 H new ATOM 0 HZ2 LYS A 131 -22.393 18.090 -8.755 1.00 4.34 H new ATOM 0 HZ3 LYS A 131 -23.818 18.979 -9.009 1.00 4.34 H new ATOM 1532 N LYS A 132 -20.234 12.918 -10.316 1.00 3.13 N ATOM 1533 CA LYS A 132 -20.664 11.554 -10.598 1.00 61.04 C ATOM 1534 C LYS A 132 -19.798 10.545 -9.851 1.00 74.40 C ATOM 1535 O LYS A 132 -20.182 9.387 -9.682 1.00 20.12 O ATOM 1536 CB LYS A 132 -20.603 11.279 -12.103 1.00 4.43 C ATOM 1537 CG LYS A 132 -21.893 10.715 -12.671 1.00 52.21 C ATOM 1538 CD LYS A 132 -22.926 11.806 -12.900 1.00 2.23 C ATOM 1539 CE LYS A 132 -23.962 11.386 -13.931 1.00 31.35 C ATOM 1540 NZ LYS A 132 -25.285 12.020 -13.677 1.00 75.13 N ATOM 0 H LYS A 132 -19.915 13.437 -11.134 1.00 3.13 H new ATOM 0 HA LYS A 132 -21.693 11.446 -10.256 1.00 61.04 H new ATOM 0 HB2 LYS A 132 -20.361 12.206 -12.624 1.00 4.43 H new ATOM 0 HB3 LYS A 132 -19.791 10.580 -12.303 1.00 4.43 H new ATOM 0 HG2 LYS A 132 -21.685 10.206 -13.612 1.00 52.21 H new ATOM 0 HG3 LYS A 132 -22.297 9.968 -11.987 1.00 52.21 H new ATOM 0 HD2 LYS A 132 -23.423 12.041 -11.959 1.00 2.23 H new ATOM 0 HD3 LYS A 132 -22.428 12.716 -13.234 1.00 2.23 H new ATOM 0 HE2 LYS A 132 -23.614 11.658 -14.927 1.00 31.35 H new ATOM 0 HE3 LYS A 132 -24.070 10.301 -13.916 1.00 31.35 H new ATOM 0 HZ1 LYS A 132 -25.964 11.709 -14.401 1.00 75.13 H new ATOM 0 HZ2 LYS A 132 -25.629 11.740 -12.736 1.00 75.13 H new ATOM 0 HZ3 LYS A 132 -25.187 13.055 -13.716 1.00 75.13 H new ATOM 1554 N LYS A 133 -18.629 10.991 -9.404 1.00 74.31 N ATOM 1555 CA LYS A 133 -17.710 10.128 -8.672 1.00 22.00 C ATOM 1556 C LYS A 133 -18.371 9.569 -7.416 1.00 53.13 C ATOM 1557 O LYS A 133 -17.944 8.546 -6.881 1.00 71.12 O ATOM 1558 CB LYS A 133 -16.444 10.901 -8.294 1.00 15.14 C ATOM 1559 CG LYS A 133 -15.291 10.009 -7.868 1.00 50.22 C ATOM 1560 CD LYS A 133 -13.955 10.716 -8.018 1.00 5.50 C ATOM 1561 CE LYS A 133 -12.797 9.809 -7.630 1.00 71.14 C ATOM 1562 NZ LYS A 133 -12.709 9.622 -6.156 1.00 23.13 N ATOM 0 H LYS A 133 -18.296 11.946 -9.536 1.00 74.31 H new ATOM 0 HA LYS A 133 -17.440 9.294 -9.320 1.00 22.00 H new ATOM 0 HB2 LYS A 133 -16.130 11.505 -9.145 1.00 15.14 H new ATOM 0 HB3 LYS A 133 -16.678 11.590 -7.483 1.00 15.14 H new ATOM 0 HG2 LYS A 133 -15.429 9.706 -6.830 1.00 50.22 H new ATOM 0 HG3 LYS A 133 -15.292 9.100 -8.469 1.00 50.22 H new ATOM 0 HD2 LYS A 133 -13.830 11.046 -9.050 1.00 5.50 H new ATOM 0 HD3 LYS A 133 -13.943 11.610 -7.394 1.00 5.50 H new ATOM 0 HE2 LYS A 133 -12.918 8.839 -8.113 1.00 71.14 H new ATOM 0 HE3 LYS A 133 -11.863 10.234 -7.999 1.00 71.14 H new ATOM 0 HZ1 LYS A 133 -11.908 8.998 -5.932 1.00 23.13 H new ATOM 0 HZ2 LYS A 133 -12.568 10.544 -5.697 1.00 23.13 H new ATOM 0 HZ3 LYS A 133 -13.590 9.193 -5.807 1.00 23.13 H new ATOM 1576 N ASP A 134 -19.416 10.246 -6.952 1.00 61.02 N ATOM 1577 CA ASP A 134 -20.138 9.815 -5.761 1.00 11.32 C ATOM 1578 C ASP A 134 -21.396 9.040 -6.139 1.00 33.14 C ATOM 1579 O ASP A 134 -22.362 8.995 -5.378 1.00 10.01 O ATOM 1580 CB ASP A 134 -20.508 11.023 -4.898 1.00 60.12 C ATOM 1581 CG ASP A 134 -19.321 11.925 -4.626 1.00 43.51 C ATOM 1582 OD1 ASP A 134 -19.075 12.844 -5.436 1.00 72.01 O ATOM 1583 OD2 ASP A 134 -18.637 11.714 -3.603 1.00 35.14 O ATOM 0 H ASP A 134 -19.782 11.095 -7.383 1.00 61.02 H new ATOM 0 HA ASP A 134 -19.485 9.156 -5.189 1.00 11.32 H new ATOM 0 HB2 ASP A 134 -21.290 11.596 -5.397 1.00 60.12 H new ATOM 0 HB3 ASP A 134 -20.922 10.676 -3.951 1.00 60.12 H new ATOM 1588 N GLY A 135 -21.378 8.431 -7.321 1.00 23.25 N ATOM 1589 CA GLY A 135 -22.523 7.667 -7.779 1.00 61.43 C ATOM 1590 C GLY A 135 -22.203 6.813 -8.991 1.00 1.34 C ATOM 1591 O GLY A 135 -21.979 7.333 -10.084 1.00 60.32 O ATOM 0 H GLY A 135 -20.591 8.453 -7.969 1.00 23.25 H new ATOM 0 HA2 GLY A 135 -22.876 7.027 -6.970 1.00 61.43 H new ATOM 0 HA3 GLY A 135 -23.337 8.349 -8.024 1.00 61.43 H new ATOM 1595 N LYS A 136 -22.179 5.499 -8.797 1.00 32.02 N ATOM 1596 CA LYS A 136 -21.884 4.570 -9.881 1.00 43.44 C ATOM 1597 C LYS A 136 -21.916 3.128 -9.387 1.00 24.15 C ATOM 1598 O LYS A 136 -22.215 2.868 -8.222 1.00 2.10 O ATOM 1599 CB LYS A 136 -20.514 4.882 -10.489 1.00 0.45 C ATOM 1600 CG LYS A 136 -19.434 5.141 -9.452 1.00 61.43 C ATOM 1601 CD LYS A 136 -18.093 5.430 -10.105 1.00 43.30 C ATOM 1602 CE LYS A 136 -17.573 4.223 -10.871 1.00 55.54 C ATOM 1603 NZ LYS A 136 -17.514 3.006 -10.015 1.00 52.43 N ATOM 0 H LYS A 136 -22.361 5.053 -7.898 1.00 32.02 H new ATOM 0 HA LYS A 136 -22.651 4.690 -10.647 1.00 43.44 H new ATOM 0 HB2 LYS A 136 -20.207 4.048 -11.120 1.00 0.45 H new ATOM 0 HB3 LYS A 136 -20.603 5.755 -11.135 1.00 0.45 H new ATOM 0 HG2 LYS A 136 -19.724 5.985 -8.826 1.00 61.43 H new ATOM 0 HG3 LYS A 136 -19.342 4.275 -8.797 1.00 61.43 H new ATOM 0 HD2 LYS A 136 -18.193 6.277 -10.784 1.00 43.30 H new ATOM 0 HD3 LYS A 136 -17.370 5.717 -9.341 1.00 43.30 H new ATOM 0 HE2 LYS A 136 -18.217 4.032 -11.729 1.00 55.54 H new ATOM 0 HE3 LYS A 136 -16.579 4.441 -11.261 1.00 55.54 H new ATOM 0 HZ1 LYS A 136 -17.001 2.253 -10.517 1.00 52.43 H new ATOM 0 HZ2 LYS A 136 -17.020 3.230 -9.127 1.00 52.43 H new ATOM 0 HZ3 LYS A 136 -18.480 2.684 -9.802 1.00 52.43 H new ATOM 1617 N ASN A 137 -21.604 2.194 -10.279 1.00 63.21 N ATOM 1618 CA ASN A 137 -21.596 0.777 -9.932 1.00 42.31 C ATOM 1619 C ASN A 137 -20.581 0.493 -8.829 1.00 11.22 C ATOM 1620 O ASN A 137 -19.434 0.936 -8.895 1.00 72.14 O ATOM 1621 CB ASN A 137 -21.276 -0.070 -11.165 1.00 45.55 C ATOM 1622 CG ASN A 137 -22.225 -1.241 -11.325 1.00 54.11 C ATOM 1623 OD1 ASN A 137 -22.815 -1.436 -12.388 1.00 62.01 O ATOM 1624 ND2 ASN A 137 -22.378 -2.027 -10.266 1.00 30.21 N ATOM 0 H ASN A 137 -21.353 2.392 -11.248 1.00 63.21 H new ATOM 0 HA ASN A 137 -22.588 0.513 -9.566 1.00 42.31 H new ATOM 0 HB2 ASN A 137 -21.324 0.557 -12.055 1.00 45.55 H new ATOM 0 HB3 ASN A 137 -20.254 -0.442 -11.092 1.00 45.55 H new ATOM 0 HD21 ASN A 137 -23.005 -2.830 -10.313 1.00 30.21 H new ATOM 0 HD22 ASN A 137 -21.869 -1.828 -9.405 1.00 30.21 H new ATOM 1631 N LYS A 138 -21.011 -0.249 -7.814 1.00 70.11 N ATOM 1632 CA LYS A 138 -20.141 -0.595 -6.696 1.00 72.22 C ATOM 1633 C LYS A 138 -19.251 0.583 -6.314 1.00 54.30 C ATOM 1634 O LYS A 138 -18.084 0.404 -5.970 1.00 44.22 O ATOM 1635 CB LYS A 138 -19.276 -1.807 -7.052 1.00 54.53 C ATOM 1636 CG LYS A 138 -18.229 -1.516 -8.114 1.00 14.54 C ATOM 1637 CD LYS A 138 -18.739 -1.849 -9.506 1.00 22.33 C ATOM 1638 CE LYS A 138 -18.355 -3.263 -9.916 1.00 1.14 C ATOM 1639 NZ LYS A 138 -18.370 -3.435 -11.395 1.00 3.23 N ATOM 0 H LYS A 138 -21.957 -0.623 -7.743 1.00 70.11 H new ATOM 0 HA LYS A 138 -20.771 -0.844 -5.842 1.00 72.22 H new ATOM 0 HB2 LYS A 138 -18.778 -2.165 -6.151 1.00 54.53 H new ATOM 0 HB3 LYS A 138 -19.921 -2.613 -7.401 1.00 54.53 H new ATOM 0 HG2 LYS A 138 -17.948 -0.464 -8.071 1.00 14.54 H new ATOM 0 HG3 LYS A 138 -17.329 -2.095 -7.907 1.00 14.54 H new ATOM 0 HD2 LYS A 138 -19.824 -1.743 -9.532 1.00 22.33 H new ATOM 0 HD3 LYS A 138 -18.332 -1.137 -10.224 1.00 22.33 H new ATOM 0 HE2 LYS A 138 -17.361 -3.495 -9.534 1.00 1.14 H new ATOM 0 HE3 LYS A 138 -19.045 -3.973 -9.461 1.00 1.14 H new ATOM 0 HZ1 LYS A 138 -18.087 -4.407 -11.634 1.00 3.23 H new ATOM 0 HZ2 LYS A 138 -19.329 -3.255 -11.756 1.00 3.23 H new ATOM 0 HZ3 LYS A 138 -17.705 -2.763 -11.829 1.00 3.23 H new ATOM 1653 N GLU A 139 -19.812 1.787 -6.375 1.00 73.04 N ATOM 1654 CA GLU A 139 -19.068 2.994 -6.035 1.00 33.13 C ATOM 1655 C GLU A 139 -18.512 2.908 -4.616 1.00 62.24 C ATOM 1656 O GLU A 139 -17.519 3.557 -4.288 1.00 54.12 O ATOM 1657 CB GLU A 139 -19.964 4.227 -6.169 1.00 34.03 C ATOM 1658 CG GLU A 139 -19.223 5.541 -5.985 1.00 73.33 C ATOM 1659 CD GLU A 139 -19.833 6.408 -4.901 1.00 51.13 C ATOM 1660 OE1 GLU A 139 -21.078 6.468 -4.818 1.00 65.41 O ATOM 1661 OE2 GLU A 139 -19.065 7.027 -4.136 1.00 2.43 O ATOM 0 H GLU A 139 -20.778 1.952 -6.656 1.00 73.04 H new ATOM 0 HA GLU A 139 -18.233 3.083 -6.730 1.00 33.13 H new ATOM 0 HB2 GLU A 139 -20.434 4.219 -7.153 1.00 34.03 H new ATOM 0 HB3 GLU A 139 -20.765 4.165 -5.433 1.00 34.03 H new ATOM 0 HG2 GLU A 139 -18.182 5.335 -5.737 1.00 73.33 H new ATOM 0 HG3 GLU A 139 -19.224 6.089 -6.927 1.00 73.33 H new ATOM 1668 N GLU A 140 -19.159 2.102 -3.781 1.00 33.23 N ATOM 1669 CA GLU A 140 -18.730 1.932 -2.398 1.00 1.14 C ATOM 1670 C GLU A 140 -17.277 1.470 -2.332 1.00 0.11 C ATOM 1671 O GLU A 140 -16.372 2.268 -2.092 1.00 0.44 O ATOM 1672 CB GLU A 140 -19.630 0.924 -1.681 1.00 32.41 C ATOM 1673 CG GLU A 140 -20.994 1.482 -1.309 1.00 25.42 C ATOM 1674 CD GLU A 140 -21.783 0.546 -0.414 1.00 63.51 C ATOM 1675 OE1 GLU A 140 -22.515 -0.312 -0.951 1.00 24.15 O ATOM 1676 OE2 GLU A 140 -21.668 0.671 0.823 1.00 5.12 O ATOM 0 H GLU A 140 -19.982 1.557 -4.038 1.00 33.23 H new ATOM 0 HA GLU A 140 -18.809 2.898 -1.899 1.00 1.14 H new ATOM 0 HB2 GLU A 140 -19.766 0.052 -2.320 1.00 32.41 H new ATOM 0 HB3 GLU A 140 -19.128 0.581 -0.776 1.00 32.41 H new ATOM 0 HG2 GLU A 140 -20.865 2.439 -0.804 1.00 25.42 H new ATOM 0 HG3 GLU A 140 -21.563 1.675 -2.218 1.00 25.42 H new ATOM 1683 N GLU A 141 -17.063 0.176 -2.547 1.00 34.44 N ATOM 1684 CA GLU A 141 -15.721 -0.393 -2.510 1.00 51.32 C ATOM 1685 C GLU A 141 -14.837 0.230 -3.587 1.00 73.45 C ATOM 1686 O GLU A 141 -13.624 0.353 -3.416 1.00 33.31 O ATOM 1687 CB GLU A 141 -15.780 -1.910 -2.698 1.00 34.24 C ATOM 1688 CG GLU A 141 -16.489 -2.636 -1.566 1.00 41.12 C ATOM 1689 CD GLU A 141 -15.686 -2.635 -0.280 1.00 14.14 C ATOM 1690 OE1 GLU A 141 -14.475 -2.934 -0.335 1.00 13.12 O ATOM 1691 OE2 GLU A 141 -16.270 -2.335 0.783 1.00 53.42 O ATOM 0 H GLU A 141 -17.802 -0.498 -2.749 1.00 34.44 H new ATOM 0 HA GLU A 141 -15.287 -0.172 -1.535 1.00 51.32 H new ATOM 0 HB2 GLU A 141 -16.289 -2.132 -3.636 1.00 34.24 H new ATOM 0 HB3 GLU A 141 -14.765 -2.297 -2.787 1.00 34.24 H new ATOM 0 HG2 GLU A 141 -17.456 -2.166 -1.387 1.00 41.12 H new ATOM 0 HG3 GLU A 141 -16.686 -3.665 -1.866 1.00 41.12 H new ATOM 1698 N TYR A 142 -15.454 0.619 -4.697 1.00 40.55 N ATOM 1699 CA TYR A 142 -14.724 1.226 -5.804 1.00 51.14 C ATOM 1700 C TYR A 142 -13.966 2.466 -5.342 1.00 45.40 C ATOM 1701 O TYR A 142 -12.736 2.471 -5.282 1.00 62.21 O ATOM 1702 CB TYR A 142 -15.686 1.595 -6.936 1.00 24.15 C ATOM 1703 CG TYR A 142 -15.125 2.618 -7.897 1.00 61.04 C ATOM 1704 CD1 TYR A 142 -14.216 2.250 -8.882 1.00 0.53 C ATOM 1705 CD2 TYR A 142 -15.505 3.952 -7.822 1.00 53.42 C ATOM 1706 CE1 TYR A 142 -13.701 3.182 -9.762 1.00 2.11 C ATOM 1707 CE2 TYR A 142 -14.996 4.891 -8.699 1.00 73.42 C ATOM 1708 CZ TYR A 142 -14.094 4.501 -9.667 1.00 31.21 C ATOM 1709 OH TYR A 142 -13.584 5.432 -10.543 1.00 32.42 O ATOM 0 H TYR A 142 -16.457 0.525 -4.854 1.00 40.55 H new ATOM 0 HA TYR A 142 -14.002 0.497 -6.172 1.00 51.14 H new ATOM 0 HB2 TYR A 142 -15.946 0.693 -7.490 1.00 24.15 H new ATOM 0 HB3 TYR A 142 -16.610 1.982 -6.505 1.00 24.15 H new ATOM 0 HD1 TYR A 142 -13.907 1.218 -8.961 1.00 0.53 H new ATOM 0 HD2 TYR A 142 -16.211 4.261 -7.065 1.00 53.42 H new ATOM 0 HE1 TYR A 142 -12.994 2.880 -10.521 1.00 2.11 H new ATOM 0 HE2 TYR A 142 -15.303 5.924 -8.627 1.00 73.42 H new ATOM 0 HH TYR A 142 -13.398 6.266 -10.063 1.00 32.42 H new ATOM 1719 N LYS A 143 -14.708 3.518 -5.015 1.00 53.51 N ATOM 1720 CA LYS A 143 -14.109 4.766 -4.556 1.00 30.23 C ATOM 1721 C LYS A 143 -13.384 4.565 -3.229 1.00 35.14 C ATOM 1722 O LYS A 143 -12.411 5.257 -2.932 1.00 60.43 O ATOM 1723 CB LYS A 143 -15.182 5.846 -4.404 1.00 75.05 C ATOM 1724 CG LYS A 143 -14.689 7.100 -3.705 1.00 4.51 C ATOM 1725 CD LYS A 143 -15.595 8.288 -3.984 1.00 30.25 C ATOM 1726 CE LYS A 143 -15.220 9.488 -3.128 1.00 34.04 C ATOM 1727 NZ LYS A 143 -15.779 10.755 -3.675 1.00 1.44 N ATOM 0 H LYS A 143 -15.727 3.531 -5.059 1.00 53.51 H new ATOM 0 HA LYS A 143 -13.383 5.087 -5.303 1.00 30.23 H new ATOM 0 HB2 LYS A 143 -15.557 6.115 -5.391 1.00 75.05 H new ATOM 0 HB3 LYS A 143 -16.022 5.435 -3.844 1.00 75.05 H new ATOM 0 HG2 LYS A 143 -14.640 6.923 -2.631 1.00 4.51 H new ATOM 0 HG3 LYS A 143 -13.676 7.328 -4.037 1.00 4.51 H new ATOM 0 HD2 LYS A 143 -15.530 8.557 -5.038 1.00 30.25 H new ATOM 0 HD3 LYS A 143 -16.631 8.010 -3.790 1.00 30.25 H new ATOM 0 HE2 LYS A 143 -15.586 9.338 -2.112 1.00 34.04 H new ATOM 0 HE3 LYS A 143 -14.134 9.566 -3.068 1.00 34.04 H new ATOM 0 HZ1 LYS A 143 -15.305 11.565 -3.227 1.00 1.44 H new ATOM 0 HZ2 LYS A 143 -15.624 10.788 -4.703 1.00 1.44 H new ATOM 0 HZ3 LYS A 143 -16.799 10.798 -3.477 1.00 1.44 H new ATOM 1741 N GLU A 144 -13.865 3.613 -2.435 1.00 35.01 N ATOM 1742 CA GLU A 144 -13.262 3.322 -1.140 1.00 21.21 C ATOM 1743 C GLU A 144 -11.781 2.986 -1.293 1.00 11.21 C ATOM 1744 O GLU A 144 -10.924 3.616 -0.674 1.00 3.30 O ATOM 1745 CB GLU A 144 -13.992 2.161 -0.462 1.00 22.44 C ATOM 1746 CG GLU A 144 -15.107 2.604 0.470 1.00 73.00 C ATOM 1747 CD GLU A 144 -14.591 3.070 1.817 1.00 14.15 C ATOM 1748 OE1 GLU A 144 -13.763 2.353 2.417 1.00 54.01 O ATOM 1749 OE2 GLU A 144 -15.016 4.153 2.272 1.00 11.03 O ATOM 0 H GLU A 144 -14.670 3.031 -2.666 1.00 35.01 H new ATOM 0 HA GLU A 144 -13.353 4.212 -0.517 1.00 21.21 H new ATOM 0 HB2 GLU A 144 -14.409 1.508 -1.229 1.00 22.44 H new ATOM 0 HB3 GLU A 144 -13.271 1.570 0.103 1.00 22.44 H new ATOM 0 HG2 GLU A 144 -15.668 3.412 0.001 1.00 73.00 H new ATOM 0 HG3 GLU A 144 -15.802 1.777 0.618 1.00 73.00 H new ATOM 1756 N SER A 145 -11.489 1.989 -2.121 1.00 70.24 N ATOM 1757 CA SER A 145 -10.113 1.566 -2.353 1.00 61.41 C ATOM 1758 C SER A 145 -9.344 2.624 -3.138 1.00 2.24 C ATOM 1759 O SER A 145 -8.183 2.909 -2.844 1.00 45.22 O ATOM 1760 CB SER A 145 -10.086 0.235 -3.108 1.00 54.43 C ATOM 1761 OG SER A 145 -8.895 0.101 -3.863 1.00 42.35 O ATOM 0 H SER A 145 -12.187 1.459 -2.643 1.00 70.24 H new ATOM 0 HA SER A 145 -9.631 1.436 -1.384 1.00 61.41 H new ATOM 0 HB2 SER A 145 -10.166 -0.590 -2.400 1.00 54.43 H new ATOM 0 HB3 SER A 145 -10.949 0.172 -3.770 1.00 54.43 H new ATOM 0 HG SER A 145 -8.902 -0.758 -4.335 1.00 42.35 H new ATOM 1767 N PHE A 146 -10.000 3.204 -4.137 1.00 71.12 N ATOM 1768 CA PHE A 146 -9.379 4.231 -4.966 1.00 31.42 C ATOM 1769 C PHE A 146 -8.975 5.438 -4.124 1.00 71.25 C ATOM 1770 O PHE A 146 -7.792 5.751 -3.997 1.00 73.01 O ATOM 1771 CB PHE A 146 -10.336 4.667 -6.077 1.00 70.33 C ATOM 1772 CG PHE A 146 -10.137 3.922 -7.366 1.00 44.14 C ATOM 1773 CD1 PHE A 146 -9.371 2.768 -7.404 1.00 32.44 C ATOM 1774 CD2 PHE A 146 -10.715 4.376 -8.541 1.00 0.03 C ATOM 1775 CE1 PHE A 146 -9.186 2.081 -8.589 1.00 5.14 C ATOM 1776 CE2 PHE A 146 -10.533 3.693 -9.729 1.00 12.42 C ATOM 1777 CZ PHE A 146 -9.768 2.544 -9.752 1.00 72.23 C ATOM 0 H PHE A 146 -10.962 2.981 -4.393 1.00 71.12 H new ATOM 0 HA PHE A 146 -8.481 3.807 -5.415 1.00 31.42 H new ATOM 0 HB2 PHE A 146 -11.362 4.524 -5.739 1.00 70.33 H new ATOM 0 HB3 PHE A 146 -10.206 5.734 -6.259 1.00 70.33 H new ATOM 0 HD1 PHE A 146 -8.913 2.401 -6.497 1.00 32.44 H new ATOM 0 HD2 PHE A 146 -11.315 5.274 -8.528 1.00 0.03 H new ATOM 0 HE1 PHE A 146 -8.587 1.183 -8.605 1.00 5.14 H new ATOM 0 HE2 PHE A 146 -10.989 4.058 -10.638 1.00 12.42 H new ATOM 0 HZ PHE A 146 -9.625 2.008 -10.679 1.00 72.23 H new ATOM 1787 N ASN A 147 -9.968 6.112 -3.553 1.00 24.24 N ATOM 1788 CA ASN A 147 -9.717 7.286 -2.724 1.00 63.42 C ATOM 1789 C ASN A 147 -8.674 6.982 -1.653 1.00 3.32 C ATOM 1790 O ASN A 147 -7.732 7.749 -1.455 1.00 40.24 O ATOM 1791 CB ASN A 147 -11.015 7.760 -2.068 1.00 71.41 C ATOM 1792 CG ASN A 147 -10.820 9.015 -1.240 1.00 23.21 C ATOM 1793 OD1 ASN A 147 -10.481 8.946 -0.058 1.00 61.33 O ATOM 1794 ND2 ASN A 147 -11.033 10.171 -1.858 1.00 34.50 N ATOM 0 H ASN A 147 -10.953 5.866 -3.649 1.00 24.24 H new ATOM 0 HA ASN A 147 -9.332 8.078 -3.366 1.00 63.42 H new ATOM 0 HB2 ASN A 147 -11.761 7.950 -2.840 1.00 71.41 H new ATOM 0 HB3 ASN A 147 -11.409 6.966 -1.433 1.00 71.41 H new ATOM 0 HD21 ASN A 147 -10.917 11.049 -1.352 1.00 34.50 H new ATOM 0 HD22 ASN A 147 -11.313 10.181 -2.839 1.00 34.50 H new ATOM 1801 N GLU A 148 -8.849 5.858 -0.965 1.00 14.41 N ATOM 1802 CA GLU A 148 -7.923 5.454 0.086 1.00 12.34 C ATOM 1803 C GLU A 148 -6.507 5.309 -0.463 1.00 21.33 C ATOM 1804 O GLU A 148 -5.552 5.840 0.104 1.00 43.35 O ATOM 1805 CB GLU A 148 -8.376 4.135 0.716 1.00 2.44 C ATOM 1806 CG GLU A 148 -7.446 3.632 1.808 1.00 73.43 C ATOM 1807 CD GLU A 148 -7.922 2.330 2.424 1.00 2.42 C ATOM 1808 OE1 GLU A 148 -8.994 2.335 3.064 1.00 12.04 O ATOM 1809 OE2 GLU A 148 -7.222 1.308 2.267 1.00 13.10 O ATOM 0 H GLU A 148 -9.623 5.211 -1.117 1.00 14.41 H new ATOM 0 HA GLU A 148 -7.920 6.231 0.851 1.00 12.34 H new ATOM 0 HB2 GLU A 148 -9.375 4.265 1.132 1.00 2.44 H new ATOM 0 HB3 GLU A 148 -8.452 3.377 -0.063 1.00 2.44 H new ATOM 0 HG2 GLU A 148 -6.448 3.490 1.394 1.00 73.43 H new ATOM 0 HG3 GLU A 148 -7.363 4.390 2.587 1.00 73.43 H new ATOM 1816 N VAL A 149 -6.379 4.584 -1.570 1.00 32.24 N ATOM 1817 CA VAL A 149 -5.081 4.368 -2.197 1.00 23.24 C ATOM 1818 C VAL A 149 -4.493 5.678 -2.709 1.00 31.02 C ATOM 1819 O VAL A 149 -3.440 6.120 -2.250 1.00 23.11 O ATOM 1820 CB VAL A 149 -5.181 3.371 -3.366 1.00 72.13 C ATOM 1821 CG1 VAL A 149 -3.891 3.361 -4.172 1.00 50.10 C ATOM 1822 CG2 VAL A 149 -5.508 1.977 -2.852 1.00 15.35 C ATOM 0 H VAL A 149 -7.159 4.136 -2.051 1.00 32.24 H new ATOM 0 HA VAL A 149 -4.425 3.954 -1.431 1.00 23.24 H new ATOM 0 HB VAL A 149 -5.990 3.690 -4.023 1.00 72.13 H new ATOM 0 HG11 VAL A 149 -3.981 2.650 -4.994 1.00 50.10 H new ATOM 0 HG12 VAL A 149 -3.705 4.357 -4.573 1.00 50.10 H new ATOM 0 HG13 VAL A 149 -3.062 3.068 -3.528 1.00 50.10 H new ATOM 0 HG21 VAL A 149 -5.575 1.286 -3.692 1.00 15.35 H new ATOM 0 HG22 VAL A 149 -4.723 1.647 -2.172 1.00 15.35 H new ATOM 0 HG23 VAL A 149 -6.461 1.998 -2.323 1.00 15.35 H new ATOM 1832 N VAL A 150 -5.182 6.296 -3.663 1.00 43.02 N ATOM 1833 CA VAL A 150 -4.729 7.557 -4.238 1.00 12.44 C ATOM 1834 C VAL A 150 -4.338 8.549 -3.147 1.00 71.34 C ATOM 1835 O VAL A 150 -3.456 9.386 -3.341 1.00 73.00 O ATOM 1836 CB VAL A 150 -5.816 8.191 -5.127 1.00 2.14 C ATOM 1837 CG1 VAL A 150 -6.395 7.158 -6.080 1.00 72.44 C ATOM 1838 CG2 VAL A 150 -6.910 8.811 -4.270 1.00 63.22 C ATOM 0 H VAL A 150 -6.056 5.944 -4.054 1.00 43.02 H new ATOM 0 HA VAL A 150 -3.856 7.331 -4.850 1.00 12.44 H new ATOM 0 HB VAL A 150 -5.359 8.983 -5.721 1.00 2.14 H new ATOM 0 HG11 VAL A 150 -7.161 7.624 -6.700 1.00 72.44 H new ATOM 0 HG12 VAL A 150 -5.602 6.766 -6.717 1.00 72.44 H new ATOM 0 HG13 VAL A 150 -6.838 6.343 -5.508 1.00 72.44 H new ATOM 0 HG21 VAL A 150 -7.669 9.254 -4.914 1.00 63.22 H new ATOM 0 HG22 VAL A 150 -7.366 8.040 -3.649 1.00 63.22 H new ATOM 0 HG23 VAL A 150 -6.479 9.583 -3.633 1.00 63.22 H new ATOM 1848 N LYS A 151 -5.000 8.449 -1.999 1.00 65.44 N ATOM 1849 CA LYS A 151 -4.721 9.335 -0.876 1.00 30.35 C ATOM 1850 C LYS A 151 -3.372 9.005 -0.244 1.00 40.54 C ATOM 1851 O LYS A 151 -2.509 9.873 -0.115 1.00 54.40 O ATOM 1852 CB LYS A 151 -5.828 9.223 0.175 1.00 53.31 C ATOM 1853 CG LYS A 151 -6.794 10.396 0.167 1.00 20.35 C ATOM 1854 CD LYS A 151 -7.393 10.616 -1.211 1.00 73.44 C ATOM 1855 CE LYS A 151 -7.002 11.971 -1.780 1.00 25.12 C ATOM 1856 NZ LYS A 151 -8.060 12.994 -1.555 1.00 74.44 N ATOM 0 H LYS A 151 -5.734 7.763 -1.822 1.00 65.44 H new ATOM 0 HA LYS A 151 -4.686 10.357 -1.252 1.00 30.35 H new ATOM 0 HB2 LYS A 151 -6.386 8.302 0.006 1.00 53.31 H new ATOM 0 HB3 LYS A 151 -5.374 9.144 1.163 1.00 53.31 H new ATOM 0 HG2 LYS A 151 -7.592 10.216 0.887 1.00 20.35 H new ATOM 0 HG3 LYS A 151 -6.274 11.299 0.487 1.00 20.35 H new ATOM 0 HD2 LYS A 151 -7.058 9.827 -1.884 1.00 73.44 H new ATOM 0 HD3 LYS A 151 -8.479 10.545 -1.152 1.00 73.44 H new ATOM 0 HE2 LYS A 151 -6.072 12.303 -1.319 1.00 25.12 H new ATOM 0 HE3 LYS A 151 -6.812 11.875 -2.849 1.00 25.12 H new ATOM 0 HZ1 LYS A 151 -7.755 13.903 -1.957 1.00 74.44 H new ATOM 0 HZ2 LYS A 151 -8.941 12.689 -2.016 1.00 74.44 H new ATOM 0 HZ3 LYS A 151 -8.224 13.105 -0.534 1.00 74.44 H new ATOM 1870 N GLU A 152 -3.197 7.746 0.145 1.00 13.51 N ATOM 1871 CA GLU A 152 -1.952 7.304 0.762 1.00 53.11 C ATOM 1872 C GLU A 152 -0.751 7.701 -0.092 1.00 32.31 C ATOM 1873 O GLU A 152 0.247 8.209 0.419 1.00 61.12 O ATOM 1874 CB GLU A 152 -1.969 5.788 0.965 1.00 23.35 C ATOM 1875 CG GLU A 152 -2.519 5.361 2.316 1.00 62.20 C ATOM 1876 CD GLU A 152 -1.584 5.701 3.461 1.00 53.24 C ATOM 1877 OE1 GLU A 152 -0.635 4.926 3.701 1.00 43.32 O ATOM 1878 OE2 GLU A 152 -1.802 6.741 4.116 1.00 13.41 O ATOM 0 H GLU A 152 -3.901 7.015 0.044 1.00 13.51 H new ATOM 0 HA GLU A 152 -1.863 7.792 1.732 1.00 53.11 H new ATOM 0 HB2 GLU A 152 -2.568 5.331 0.177 1.00 23.35 H new ATOM 0 HB3 GLU A 152 -0.955 5.404 0.857 1.00 23.35 H new ATOM 0 HG2 GLU A 152 -3.481 5.845 2.482 1.00 62.20 H new ATOM 0 HG3 GLU A 152 -2.700 4.286 2.307 1.00 62.20 H new ATOM 1885 N VAL A 153 -0.855 7.464 -1.396 1.00 14.02 N ATOM 1886 CA VAL A 153 0.221 7.796 -2.322 1.00 12.45 C ATOM 1887 C VAL A 153 0.362 9.306 -2.481 1.00 75.05 C ATOM 1888 O VAL A 153 1.472 9.831 -2.550 1.00 3.33 O ATOM 1889 CB VAL A 153 -0.015 7.164 -3.706 1.00 43.22 C ATOM 1890 CG1 VAL A 153 -1.360 7.597 -4.269 1.00 43.33 C ATOM 1891 CG2 VAL A 153 1.114 7.531 -4.658 1.00 1.02 C ATOM 0 H VAL A 153 -1.674 7.043 -1.835 1.00 14.02 H new ATOM 0 HA VAL A 153 1.140 7.391 -1.899 1.00 12.45 H new ATOM 0 HB VAL A 153 -0.028 6.080 -3.594 1.00 43.22 H new ATOM 0 HG11 VAL A 153 -1.509 7.140 -5.247 1.00 43.33 H new ATOM 0 HG12 VAL A 153 -2.156 7.279 -3.595 1.00 43.33 H new ATOM 0 HG13 VAL A 153 -1.381 8.682 -4.368 1.00 43.33 H new ATOM 0 HG21 VAL A 153 0.931 7.076 -5.632 1.00 1.02 H new ATOM 0 HG22 VAL A 153 1.160 8.615 -4.767 1.00 1.02 H new ATOM 0 HG23 VAL A 153 2.060 7.166 -4.259 1.00 1.02 H new ATOM 1901 N GLN A 154 -0.772 9.998 -2.540 1.00 20.50 N ATOM 1902 CA GLN A 154 -0.775 11.448 -2.692 1.00 65.31 C ATOM 1903 C GLN A 154 -0.127 12.123 -1.487 1.00 72.54 C ATOM 1904 O GLN A 154 0.434 13.212 -1.601 1.00 72.11 O ATOM 1905 CB GLN A 154 -2.205 11.960 -2.871 1.00 45.35 C ATOM 1906 CG GLN A 154 -2.295 13.470 -3.024 1.00 10.13 C ATOM 1907 CD GLN A 154 -2.340 14.189 -1.690 1.00 51.51 C ATOM 1908 OE1 GLN A 154 -1.543 15.091 -1.431 1.00 2.31 O ATOM 1909 NE2 GLN A 154 -3.276 13.794 -0.835 1.00 61.21 N ATOM 0 H GLN A 154 -1.700 9.578 -2.485 1.00 20.50 H new ATOM 0 HA GLN A 154 -0.194 11.696 -3.580 1.00 65.31 H new ATOM 0 HB2 GLN A 154 -2.644 11.487 -3.749 1.00 45.35 H new ATOM 0 HB3 GLN A 154 -2.802 11.654 -2.012 1.00 45.35 H new ATOM 0 HG2 GLN A 154 -1.438 13.825 -3.595 1.00 10.13 H new ATOM 0 HG3 GLN A 154 -3.187 13.721 -3.598 1.00 10.13 H new ATOM 0 HE21 GLN A 154 -3.916 13.042 -1.091 1.00 61.21 H new ATOM 0 HE22 GLN A 154 -3.355 14.242 0.078 1.00 61.21 H new ATOM 1918 N ALA A 155 -0.210 11.468 -0.334 1.00 5.04 N ATOM 1919 CA ALA A 155 0.370 12.004 0.892 1.00 53.12 C ATOM 1920 C ALA A 155 1.858 11.683 0.982 1.00 34.21 C ATOM 1921 O ALA A 155 2.677 12.559 1.263 1.00 74.03 O ATOM 1922 CB ALA A 155 -0.365 11.457 2.106 1.00 32.44 C ATOM 0 H ALA A 155 -0.673 10.566 -0.223 1.00 5.04 H new ATOM 0 HA ALA A 155 0.260 13.088 0.873 1.00 53.12 H new ATOM 0 HB1 ALA A 155 0.078 11.865 3.014 1.00 32.44 H new ATOM 0 HB2 ALA A 155 -1.416 11.743 2.055 1.00 32.44 H new ATOM 0 HB3 ALA A 155 -0.285 10.370 2.120 1.00 32.44 H new ATOM 1928 N LEU A 156 2.201 10.422 0.743 1.00 22.15 N ATOM 1929 CA LEU A 156 3.592 9.984 0.798 1.00 12.45 C ATOM 1930 C LEU A 156 4.473 10.859 -0.087 1.00 4.31 C ATOM 1931 O LEU A 156 4.008 11.430 -1.073 1.00 61.34 O ATOM 1932 CB LEU A 156 3.704 8.522 0.364 1.00 44.12 C ATOM 1933 CG LEU A 156 3.759 7.489 1.490 1.00 11.32 C ATOM 1934 CD1 LEU A 156 5.104 7.541 2.197 1.00 24.11 C ATOM 1935 CD2 LEU A 156 2.625 7.719 2.479 1.00 25.23 C ATOM 0 H LEU A 156 1.536 9.685 0.509 1.00 22.15 H new ATOM 0 HA LEU A 156 3.937 10.078 1.828 1.00 12.45 H new ATOM 0 HB2 LEU A 156 2.853 8.288 -0.275 1.00 44.12 H new ATOM 0 HB3 LEU A 156 4.601 8.413 -0.246 1.00 44.12 H new ATOM 0 HG LEU A 156 3.640 6.497 1.054 1.00 11.32 H new ATOM 0 HD11 LEU A 156 5.124 6.799 2.995 1.00 24.11 H new ATOM 0 HD12 LEU A 156 5.899 7.328 1.483 1.00 24.11 H new ATOM 0 HD13 LEU A 156 5.254 8.534 2.621 1.00 24.11 H new ATOM 0 HD21 LEU A 156 2.679 6.975 3.274 1.00 25.23 H new ATOM 0 HD22 LEU A 156 2.714 8.717 2.909 1.00 25.23 H new ATOM 0 HD23 LEU A 156 1.669 7.630 1.963 1.00 25.23 H new